N-isopropyl-1,3-benzothiazole-2-carboxamide
TL;DR: N-isopropyl-1,3-benzothiazole-2-carboxamide (CAS 41124-28-1) is a chemical compound with molecular formula C11H12N2OS and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propan-2-yl-1,3-benzothiazole-2-carboxamide
Also Known As: SDCCGMLS-0045007.P002, BAS 08845202, N-isopropylbenzo[d]thiazole-2-carboxamide, benzothiazol-2-yl-N-(methylethyl)carboxamide, N-isopropyl-1,3-benzothiazole-2-carboxamide
| Molecular Formula | C11H12N2OS |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 2.4345 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.06703 |
| Heavy Atoms | 15 |
| Complexity | 457.04852 |
Chemical Identifiers
| CAS Number | 41124-28-1 |
|---|---|
| SMILES | CC(C)NC(=O)C1=NC2=CC=CC=C2S1 |
Product Overview
N-isopropyl-1,3-benzothiazole-2-carboxamide (CAS 41124-28-1), with molecular formula C11H12N2OS and molecular weight 220.07 g/mol. IUPAC: N-propan-2-yl-1,3-benzothiazole-2-carboxamide.
Chemical Property Profile of N-isopropyl-1,3-benzothiazole-2-carboxamide
Property Insights of N-isopropyl-1,3-benzothiazole-2-carboxamide
The XLogP value of 2.4345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isopropyl-1,3-benzothiazole-2-carboxamide. With a topological polar surface area (TPSA) of 41.99 Ų, N-isopropyl-1,3-benzothiazole-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isopropyl-1,3-benzothiazole-2-carboxamide has 1 hydrogen bond donor(s) and 3 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-isopropyl-1,3-benzothiazole-2-carboxamide?
The CAS number of N-isopropyl-1,3-benzothiazole-2-carboxamide is 41124-28-1.
What is the molecular formula of N-isopropyl-1,3-benzothiazole-2-carboxamide?
The molecular formula of N-isopropyl-1,3-benzothiazole-2-carboxamide is C11H12N2OS.
What is the molecular weight of N-isopropyl-1,3-benzothiazole-2-carboxamide?
The molecular weight of N-isopropyl-1,3-benzothiazole-2-carboxamide is 220.07 g/mol.
Where can I buy N-isopropyl-1,3-benzothiazole-2-carboxamide?
You can request a quote for N-isopropyl-1,3-benzothiazole-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isopropyl-1,3-benzothiazole-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-isopropyl-1,3-benzothiazole-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.