Products Categories
| CAS No.: | 149682-77-9 |
|---|---|
| Name: | VAL-BORO-PRO |
| Molecular Structure: | |
|
|
|
| Formula: | C9H19BN2O3 |
| Molecular Weight: | 214.15 |
| Synonyms: | VAL-BORO-PRO;Talabostat (PT100);talabostat;Boronic acid, ((2R)-1-((2S)-2-amino-3-methyl-1-oxobutyl)-2-pyrrolidinyl)-;Boronic acid, (1-(2-amino-3-methyl-1-oxobutyl)-2-pyrrolidinyl)-, (R-(R*,S*))-;Pt 100;Unii-kz1o2sh88z;[(2R)-1-[(2S)-2-Amino-3-methyl-1-oxobutyl]-2-pyrrolidinyl]boronic acid |
| Density: | 1.155 g/cm3 |
| Boiling Point: | 421.437 °C at 760 mmHg |
| Flash Point: | 208.678 °C |
| PSA: | 86.79000 |
| LogP: | 0.03080 |
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 73441-42-6METHYL-5-CHLORO-2,2-DIMETHYLVALERATE
- 211914-50-0N-[[2-[[[4-(Aminoiminomethyl)phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-(2-pyridinyl)-beta-alanine ethyl ester hydrochloride
What can I do for you?
Get Best Price
Specification
The Talabostat, with the CAS registry number 149682-77-9, is also known as [(2R)-1-(L-Valyl)-2-pyrrolidinyl]boronic acid. It belongs to the classification codes of Hematopoietic Stimulant; Treatment of Cancer; Treatment of Cancer; Hematopoietic Stimulant. This chemical's molecular formula is C9H19BN2O3 and molecular weight is 214.15. What's more, its IUPAC name is called [(2R)-1-[(2S)-2-Amino-3-methyl-1-oxobutyl]-2-pyrrolidinyl]boronic acid.
Physical properties about Talabostat are: (1)ACD/LogP: 0.009; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.62; (4)ACD/LogD (pH 7.4): -0.95; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 2.67; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 86.79 Å2; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 55.766 cm3; (15)Molar Volume: 185.265 cm3; (16)Polarizability: 22.107×10-24cm3; (17)Surface Tension: 46.64 dyne/cm; (18)Density: 1.155 g/cm3; (19)Flash Point: 208.678 °C; (20)Enthalpy of Vaporization: 78.014 kJ/mol; (21)Boiling Point: 421.437 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N1CCC[C@H]1B(O)O)[C@@H](N)C(C)C
(2) InChI: InChI=1S/C9H19BN2O3/c1-6(2)8(11)9(13)12-5-3-4-7(12)10(14)15/h6-8,14-15H,3-5,11H2,1-2H3/t7-,8-/m0/s1
(3) InChIKey: FKCMADOPPWWGNZ-YUMQZZPRSA-N