A1963/0082570
TL;DR: A1963/0082570 (CAS 1396967-61-5) is a chemical compound with molecular formula C19H24N4O4S2 and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxobutan-2-yl] 2-benzamido-4-methylsulfanylbutanoate
Also Known As: A1963/0082570, Methionine, N-benzoyl-, 1-[[(5-methyl-1,3,4-thiadiazol-2-yl)amino]carbonyl]propyl ester, 1-[(5-METHYL-1,3,4-THIADIAZOL-2-YL)CARBAMOYL]PROPYL 4-(METHYLSULFANYL)-2-(PHENYLFORMAMIDO)BUTANOATE, 1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxobutan-2-yl N-(phenylcarbonyl)methioninate, 1-[(5-Methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxobutan-2-yl N-benzoylmethioninate
| Molecular Formula | C19H24N4O4S2 |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 2.65852 |
| Topological Polar Surface Area | 110.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 436.1239 |
| Heavy Atoms | 29 |
| Complexity | 828.62646 |
Chemical Identifiers
| CAS Number | 1396967-61-5 |
|---|---|
| SMILES | CCC(C(=O)NC1=NN=C(S1)C)OC(=O)C(CCSC)NC(=O)C2=CC=CC=C2 |
Product Overview
A1963/0082570 (CAS 1396967-61-5), with molecular formula C19H24N4O4S2 and molecular weight 436.12 g/mol. IUPAC: [1-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-1-oxobutan-2-yl] 2-benzamido-4-methylsulfanylbutanoate.
Chemical Property Profile of A1963/0082570
Property Insights of A1963/0082570
The XLogP value of 2.65852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A1963/0082570. The TPSA of 110.28 Ų falls within the moderate polarity range, balancing permeability and solubility for A1963/0082570. Following Lipinski's Rule of Five, A1963/0082570 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1963/0082570?
The CAS number of A1963/0082570 is 1396967-61-5.
What is the molecular formula of A1963/0082570?
The molecular formula of A1963/0082570 is C19H24N4O4S2.
What is the molecular weight of A1963/0082570?
The molecular weight of A1963/0082570 is 436.12 g/mol.
Where can I buy A1963/0082570?
You can request a quote for A1963/0082570 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1963/0082570?
Yes, KEHONG BIO provides custom synthesis services for A1963/0082570 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.