Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate
TL;DR: Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate (CAS 17512-70-8) is a chemical compound with molecular formula C18H22N2O4S and molecular weight 362.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[3-[(4-methylphenyl)sulfonylamino]propyl]carbamate
Also Known As: 3-phthalimidomethyl-3-methyloxetane, benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate, benzyl N-[3-(p-tolylsulfonylamino)propyl]carbamate, benzyl(3-{[(4-methylphenyl)sulfonyl]amino}propyl)carbamate, N'-(p-Toluolsulfonyl)-N-benzyloxycarbonyl-1,3-diamino-propan
| Molecular Formula | C18H22N2O4S |
|---|---|
| Molecular Weight | 362.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 92.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 362.13004 |
| Heavy Atoms | 25 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 17512-70-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCCCNC(=O)OCC2=CC=CC=C2 |
| InChIKey | LOBBCVCUACLFOG-UHFFFAOYSA-N |
Product Overview
Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate (CAS 17512-70-8), with molecular formula C18H22N2O4S and molecular weight 362.13 g/mol. IUPAC: benzyl N-[3-[(4-methylphenyl)sulfonylamino]propyl]carbamate.
Chemical Property Profile of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate
Property Insights of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate. The TPSA of 92.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate. Following Lipinski's Rule of Five, Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate has 2 hydrogen bond donor(s) and 5 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 Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate?
The CAS number of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate is 17512-70-8.
What is the molecular formula of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate?
The molecular formula of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate is C18H22N2O4S.
What is the molecular weight of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate?
The molecular weight of Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate is 362.13 g/mol.
Where can I buy Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate?
You can request a quote for Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl (3-((4-methylphenyl)sulfonamido)propyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.