N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
TL;DR: N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide (CAS 6243-28-3) is a chemical compound with molecular formula C20H21N3O5S2 and molecular weight 447.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide, N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide, N-(4,6-dimethoxybenzothiazol-2-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide
| Molecular Formula | C20H21N3O5S2 |
|---|---|
| Molecular Weight | 447.09 g/mol |
| LogP | 3.3503 |
| Topological Polar Surface Area | 97.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.09225 |
| Heavy Atoms | 30 |
| Complexity | 1183.1223 |
Chemical Identifiers
| CAS Number | 6243-28-3 |
|---|---|
| SMILES | COC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)OC |
Product Overview
N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide (CAS 6243-28-3), with molecular formula C20H21N3O5S2 and molecular weight 447.09 g/mol. IUPAC: N-(4,6-dimethoxy-1,3-benzothiazol-2-yl)-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
Property Insights of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
The XLogP value of 3.3503 indicates that N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.83 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide. Following Lipinski's Rule of Five, N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide has 1 hydrogen bond donor(s) and 7 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-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide?
The CAS number of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide is 6243-28-3.
What is the molecular formula of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide?
The molecular formula of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide is C20H21N3O5S2.
What is the molecular weight of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide?
The molecular weight of N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide is 447.09 g/mol.
Where can I buy N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide?
You can request a quote for N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-Dimethoxy-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.