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1123889-87-1

Basic Information
CAS No.: 1123889-87-1
Name: XL-765,SAR245409
Article Data: 1
Molecular Structure:
Molecular Structure of 1123889-87-1 (XL-765,SAR245409)
Formula: C31H29N5O6S
Molecular Weight: 599.66
Synonyms: XL-765;
Density: 1.387 g/cm3
PSA: 152.38000
LogP: 6.40940
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    5ginstock.Appearance:white power Package:100mg;500mg;1g;5g;10g

    Established in 2012, Chendu Novi Biotechnology Co.,Ltd is a high-tech company principally engaged in active pharmaceutical ingredient (API) research, development and manufacture, e

  • Chengdu NoVi Biotechnology Co., Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:13551243286/028-81458053

    Address:NO.168-1-224 JULONG ROAD WUHOU DISTRICT, CHENGDU CITY,SICHUAN PROVINCE

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  • XL765

  • Casno:

    1123889-87-1

    XL765

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    XL765

      Shanghai Haoyuan Chemexpress is an innovative company, which is located in Zhangjiang High-tech Park in Shanghai, China. we are specialized in custom synthesis of or

  • Shanghai Haoyuan Chemexpress Co., Ltd.

    China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:86-21-51870955;58998985;58999585

    Address:Room 601, No. 2 BLD, NO. 720, Cailun Road, Zhangjiang, Shanghai, China

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Specification

The XL765(SAR245409), with the CAS registry number of 1123889-87-1, is also known as XL-765. This chemical's molecular formula is C31H29N5O6S and molecular weight is 599.6569. What's more, its systematic name is N-[4-[[3-(3, 5-Dimethoxyanilino)quinoxalin-2-yl]sulfamoyl]phenyl]-3-methoxy-4-methyl-benzamide.

Physical properties about XL765(SAR245409) are: (1)ACD/LogP: 5.73; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 5.62; (4)ACD/LogD (pH 7.4): 4.443; (5)ACD/BCF (pH 5.5): 10359.059; (6)ACD/BCF (pH 7.4): 689.086; (7)ACD/KOC (pH 5.5): 24274.828; (8)ACD/KOC (pH 7.4): 1614.764; (9)#H bond acceptors: 11; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 149.15 Å2; (13)Index of Refraction: 1.674; (14)Molar Refractivity: 162.267 cm3; (15)Molar Volume: 432.309 cm3; (16)Surface Tension: 67.985 dyne/cm; (17)Density: 1.387 g/cm3.

You can still convert the following datas into molecular structure:
(1) SMILES: Cc1ccc(cc1OC)C(=O)Nc2ccc(cc2)S(=O)(=O)Nc3c(nc4ccccc4n3)Nc5cc(cc(c5)OC)OC
(2) InChI: InChI=1/C31H29N5O6S/c1-19-9-10-20(15-28(19)42-4)31(37)33-21-11-13-25(14-12-21)43(38,39)36-30-29(34-26-7-5-6-8-27(26)35-30)32-22-16-23(40-2)18-24(17-22)41-3/h5-18H,1-4H3,(H,32,34)(H,33,37)(H,35,36)
(3) InChIKey: HJSSPYJVWLTYHG-UHFFFAOYAH