N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1
TL;DR: N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 (CAS 331852-98-3) is a chemical compound with molecular formula C14H11ClN4O7S2 and molecular weight 445.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazin-7-yl)sulfonyl]-4-nitrobenzamide
Also Known As: N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1, N-((6-chloro-1,1-dioxido-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazin-7-yl)sulfonyl)-4-nitrobenzamide, N-[(6-chloro-1,1-dioxido-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-4-nitrobenzamide, N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazin-7-yl)sulfonyl]-4-nitrobenzamide
| Molecular Formula | C14H11ClN4O7S2 |
|---|---|
| Molecular Weight | 445.98 g/mol |
| LogP | 1.0282 |
| Topological Polar Surface Area | 164.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.97577 |
| Heavy Atoms | 28 |
| Complexity | 1194.9408 |
Chemical Identifiers
| CAS Number | 331852-98-3 |
|---|---|
| SMILES | C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl |
Product Overview
N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 (CAS 331852-98-3), with molecular formula C14H11ClN4O7S2 and molecular weight 445.98 g/mol. IUPAC: N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazin-7-yl)sulfonyl]-4-nitrobenzamide.
Chemical Property Profile of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1
Property Insights of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1
The XLogP value of 1.0282 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1. The TPSA of 164.58 Ų indicates high polarity, suggesting N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 has 3 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 N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1?
The CAS number of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 is 331852-98-3.
What is the molecular formula of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1?
The molecular formula of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 is C14H11ClN4O7S2.
What is the molecular weight of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1?
The molecular weight of N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 is 445.98 g/mol.
Where can I buy N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1?
You can request a quote for N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1?
Yes, KEHONG BIO provides custom synthesis services for N-[(6-chloro-1,1-dioxo-3,4-dihydro-2H-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.