ASN 12972508
TL;DR: ASN 12972508 (CAS 878735-04-7) is a chemical compound with molecular formula C15H16N6O2S and molecular weight 344.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(4-methoxyphenyl)-5-methyltriazole-4-carboxamide
Also Known As: ASN 12972508, VU0509813-1, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(4-methoxyphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide, F3126-1190, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(4-methoxyphenyl)-5-methyltriazole-4-carboxamide
| Molecular Formula | C15H16N6O2S |
|---|---|
| Molecular Weight | 344.11 g/mol |
| LogP | 2.25052 |
| Topological Polar Surface Area | 94.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 344.10553 |
| Heavy Atoms | 24 |
| Complexity | 855.2339 |
Chemical Identifiers
| CAS Number | 878735-04-7 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2=C(N(N=N2)C3=CC=C(C=C3)OC)C |
Product Overview
ASN 12972508 (CAS 878735-04-7), with molecular formula C15H16N6O2S and molecular weight 344.11 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(4-methoxyphenyl)-5-methyltriazole-4-carboxamide.
Chemical Property Profile of ASN 12972508
Property Insights of ASN 12972508
The XLogP value of 2.25052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ASN 12972508. The TPSA of 94.82 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12972508. Following Lipinski's Rule of Five, ASN 12972508 has 1 hydrogen bond donor(s) and 7 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 ASN 12972508?
The CAS number of ASN 12972508 is 878735-04-7.
What is the molecular formula of ASN 12972508?
The molecular formula of ASN 12972508 is C15H16N6O2S.
What is the molecular weight of ASN 12972508?
The molecular weight of ASN 12972508 is 344.11 g/mol.
Where can I buy ASN 12972508?
You can request a quote for ASN 12972508 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12972508?
Yes, KEHONG BIO provides custom synthesis services for ASN 12972508 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.