ASN 12972907
TL;DR: ASN 12972907 (CAS 878735-48-9) is a chemical compound with molecular formula C16H18N6O2S2 and molecular weight 390.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxyphenyl)-5-methyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide
Also Known As: ASN 12972907, 1-(4-methoxyphenyl)-5-methyl-N-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-1H-1,2,3-triazole-4-carboxamide, F3126-1589, 1-(4-methoxyphenyl)-5-methyl-N-(5-(propylthio)-1,3,4-thiadiazol-2-yl)-1H-1,2,3-triazole-4-carboxamide, 1-(4-methoxyphenyl)-5-methyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide
| Molecular Formula | C16H18N6O2S2 |
|---|---|
| Molecular Weight | 390.09 g/mol |
| LogP | 3.19022 |
| Topological Polar Surface Area | 94.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.09326 |
| Heavy Atoms | 26 |
| Complexity | 890.5395 |
Chemical Identifiers
| CAS Number | 878735-48-9 |
|---|---|
| SMILES | CCCSC1=NN=C(S1)NC(=O)C2=C(N(N=N2)C3=CC=C(C=C3)OC)C |
Product Overview
ASN 12972907 (CAS 878735-48-9), with molecular formula C16H18N6O2S2 and molecular weight 390.09 g/mol. IUPAC: 1-(4-methoxyphenyl)-5-methyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)triazole-4-carboxamide.
Chemical Property Profile of ASN 12972907
Property Insights of ASN 12972907
The XLogP value of 3.19022 indicates that ASN 12972907 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.82 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 12972907. Following Lipinski's Rule of Five, ASN 12972907 has 1 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 ASN 12972907?
The CAS number of ASN 12972907 is 878735-48-9.
What is the molecular formula of ASN 12972907?
The molecular formula of ASN 12972907 is C16H18N6O2S2.
What is the molecular weight of ASN 12972907?
The molecular weight of ASN 12972907 is 390.09 g/mol.
Where can I buy ASN 12972907?
You can request a quote for ASN 12972907 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 12972907?
Yes, KEHONG BIO provides custom synthesis services for ASN 12972907 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.