![butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate structure](/static/products/3524/352441-25-9.webp)
butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate
TL;DR: butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate (CAS 352441-25-9) is a chemical compound with molecular formula C13H17N5O4S and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-[4-(1,2,4-triazol-4-ylsulfamoyl)phenyl]carbamate
Also Known As: butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate, butyl N-[4-(1,2,4-triazol-4-ylsulfamoyl)phenyl]carbamate, butyl (4-(N-(4H-1,2,4-triazol-4-yl)sulfamoyl)phenyl)carbamate
| Molecular Formula | C13H17N5O4S |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 1.5591 |
| Topological Polar Surface Area | 115.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 339.10013 |
| Heavy Atoms | 23 |
| Complexity | 728.23517 |
Chemical Identifiers
| CAS Number | 352441-25-9 |
|---|---|
| SMILES | CCCCOC(=O)NC1=CC=C(C=C1)S(=O)(=O)NN2C=NN=C2 |
Product Overview
butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate (CAS 352441-25-9), with molecular formula C13H17N5O4S and molecular weight 339.10 g/mol. IUPAC: butyl N-[4-(1,2,4-triazol-4-ylsulfamoyl)phenyl]carbamate.
Chemical Property Profile of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate
Property Insights of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate
The XLogP value of 1.5591 suggests moderate lipophilicity, balancing water solubility and membrane permeability for butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate. The TPSA of 115.21 Ų falls within the moderate polarity range, balancing permeability and solubility for butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate. Following Lipinski's Rule of Five, butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate has 2 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 butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate?
The CAS number of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate is 352441-25-9.
What is the molecular formula of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate?
The molecular formula of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate is C13H17N5O4S.
What is the molecular weight of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate?
The molecular weight of butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate is 339.10 g/mol.
Where can I buy butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate?
You can request a quote for butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for butyl 4-[(4H-1,2,4-triazol-4-ylamino)sulfonyl]phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.