BAS 13389273
TL;DR: BAS 13389273 (CAS 878437-58-2) 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.
2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: BAS 13389273, 2-{[5-(4-methoxybenzyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide, 2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide, 2-[[5-[(4-Methoxyphenyl)methyl]-4-methyl-4H-1,2,4-triazol-3-yl]thio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
| Molecular Formula | C16H18N6O2S2 |
|---|---|
| Molecular Weight | 390.09 g/mol |
| LogP | 2.30522 |
| 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 | 878437-58-2 |
|---|---|
| SMILES | CC1=NN=C(S1)NC(=O)CSC2=NN=C(N2C)CC3=CC=C(C=C3)OC |
Product Overview
BAS 13389273 (CAS 878437-58-2), with molecular formula C16H18N6O2S2 and molecular weight 390.09 g/mol. IUPAC: 2-[[5-[(4-methoxyphenyl)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.
Chemical Property Profile of BAS 13389273
Property Insights of BAS 13389273
The XLogP value of 2.30522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13389273. The TPSA of 94.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13389273. Following Lipinski's Rule of Five, BAS 13389273 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 BAS 13389273?
The CAS number of BAS 13389273 is 878437-58-2.
What is the molecular formula of BAS 13389273?
The molecular formula of BAS 13389273 is C16H18N6O2S2.
What is the molecular weight of BAS 13389273?
The molecular weight of BAS 13389273 is 390.09 g/mol.
Where can I buy BAS 13389273?
You can request a quote for BAS 13389273 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13389273?
Yes, KEHONG BIO provides custom synthesis services for BAS 13389273 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.