AB01291681-01
TL;DR: AB01291681-01 (CAS 879468-72-1) is a chemical compound with molecular formula C14H13N5O2S and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-5-carboxamide
Also Known As: AB01291681-01, 5-(2-hydroxy-4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-3-carboxamide, 3-(2-hydroxy-4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-5-carboxamide, 5-(4-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1,2-dihydropyrazole-3-carboxamide
| Molecular Formula | C14H13N5O2S |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 2.50294 |
| Topological Polar Surface Area | 103.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.079 |
| Heavy Atoms | 22 |
| Complexity | 839.38324 |
Chemical Identifiers
| CAS Number | 879468-72-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C2=NNC(=C2)C(=O)NC3=NN=C(S3)C)O |
Product Overview
AB01291681-01 (CAS 879468-72-1), with molecular formula C14H13N5O2S and molecular weight 315.08 g/mol. IUPAC: 3-(2-hydroxy-4-methylphenyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of AB01291681-01
Property Insights of AB01291681-01
The XLogP value of 2.50294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01291681-01. The TPSA of 103.79 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01291681-01. Following Lipinski's Rule of Five, AB01291681-01 has 3 hydrogen bond donor(s) and 6 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 AB01291681-01?
The CAS number of AB01291681-01 is 879468-72-1.
What is the molecular formula of AB01291681-01?
The molecular formula of AB01291681-01 is C14H13N5O2S.
What is the molecular weight of AB01291681-01?
The molecular weight of AB01291681-01 is 315.08 g/mol.
Where can I buy AB01291681-01?
You can request a quote for AB01291681-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01291681-01?
Yes, KEHONG BIO provides custom synthesis services for AB01291681-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.