ChemDiv1_022467
TL;DR: ChemDiv1_022467 (CAS 325702-27-0) is a chemical compound with molecular formula C22H27N3O5S and molecular weight 445.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[4-[3-[benzyl(methyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate
Also Known As: ChemDiv1_022467, F0774-0095, methyl N-[4-({3-[benzyl(methyl)carbamoyl]piperidin-1-yl}sulfonyl)phenyl]carbamate, methyl (4-((3-(benzyl(methyl)carbamoyl)piperidin-1-yl)sulfonyl)phenyl)carbamate, methyl N-[4-[3-[benzyl(methyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate
| Molecular Formula | C22H27N3O5S |
|---|---|
| Molecular Weight | 445.17 g/mol |
| LogP | 2.9242 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 445.16714 |
| Heavy Atoms | 31 |
| Complexity | 1009.2017 |
Chemical Identifiers
| CAS Number | 325702-27-0 |
|---|---|
| SMILES | CN(CC1=CC=CC=C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC |
Product Overview
ChemDiv1_022467 (CAS 325702-27-0), with molecular formula C22H27N3O5S and molecular weight 445.17 g/mol. IUPAC: methyl N-[4-[3-[benzyl(methyl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate.
Chemical Property Profile of ChemDiv1_022467
Property Insights of ChemDiv1_022467
The XLogP value of 2.9242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_022467. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_022467. Following Lipinski's Rule of Five, ChemDiv1_022467 has 1 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 ChemDiv1_022467?
The CAS number of ChemDiv1_022467 is 325702-27-0.
What is the molecular formula of ChemDiv1_022467?
The molecular formula of ChemDiv1_022467 is C22H27N3O5S.
What is the molecular weight of ChemDiv1_022467?
The molecular weight of ChemDiv1_022467 is 445.17 g/mol.
Where can I buy ChemDiv1_022467?
You can request a quote for ChemDiv1_022467 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_022467?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_022467 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.