N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide
TL;DR: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide (CAS 797776-56-8) is a chemical compound with molecular formula C11H10Cl2N2OS and molecular weight 287.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide
Also Known As: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide, BAS 08207489, N-(4,5-dichlorobenzo[d]thiazol-2-yl)isobutyramide, F1813-0629, AP-970/42769469
| Molecular Formula | C11H10Cl2N2OS |
|---|---|
| Molecular Weight | 287.99 g/mol |
| LogP | 4.1976 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.98907 |
| Heavy Atoms | 17 |
| Complexity | 580.1003 |
Chemical Identifiers
| CAS Number | 797776-56-8 |
|---|---|
| SMILES | CC(C)C(=O)NC1=NC2=C(S1)C=CC(=C2Cl)Cl |
Product Overview
N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide (CAS 797776-56-8), with molecular formula C11H10Cl2N2OS and molecular weight 287.99 g/mol. IUPAC: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide.
Chemical Property Profile of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide
Property Insights of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide
The XLogP value of 4.1976 indicates that N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide 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-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide?
The CAS number of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide is 797776-56-8.
What is the molecular formula of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide?
The molecular formula of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide is C11H10Cl2N2OS.
What is the molecular weight of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide?
The molecular weight of N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide is 287.99 g/mol.
Where can I buy N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide?
You can request a quote for N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.