n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine
TL;DR: n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine (CAS 31789-98-7) is a chemical compound with molecular formula C19H15N3O4S and molecular weight 381.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(benzenesulfonyl)-N-(3-nitrophenyl)benzenecarboximidamide
Also Known As: UPCMLD0ENAT0400-0134:001, n2-benzenesulfonyl-n1-(3-nitrophenyl)benzamidine, N'-(benzenesulfonyl)-N-(3-nitrophenyl)benzenecarboximidamide, (E)-N'-(BENZENESULFONYL)-N-(3-NITROPHENYL)BENZENECARBOXIMIDAMIDE
| Molecular Formula | C19H15N3O4S |
|---|---|
| Molecular Weight | 381.08 g/mol |
| LogP | 3.8424 |
| Topological Polar Surface Area | 101.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.07834 |
| Heavy Atoms | 27 |
| Complexity | 1082.2073 |
Chemical Identifiers
| CAS Number | 31789-98-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NS(=O)(=O)C2=CC=CC=C2)NC3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine (CAS 31789-98-7), with molecular formula C19H15N3O4S and molecular weight 381.08 g/mol. IUPAC: N'-(benzenesulfonyl)-N-(3-nitrophenyl)benzenecarboximidamide.
Chemical Property Profile of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine
Property Insights of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine
The XLogP value of 3.8424 indicates that n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.67 Ų falls within the moderate polarity range, balancing permeability and solubility for n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine. Following Lipinski's Rule of Five, n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine has 1 hydrogen bond donor(s) and 4 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 n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine?
The CAS number of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine is 31789-98-7.
What is the molecular formula of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine?
The molecular formula of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine is C19H15N3O4S.
What is the molecular weight of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine?
The molecular weight of n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine is 381.08 g/mol.
Where can I buy n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine?
You can request a quote for n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine?
Yes, KEHONG BIO provides custom synthesis services for n2-Benzenesulfonyl-n1-(3-nitrophenyl)benzamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.