![2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide structure](/static/products/1005/1005666-88-5.webp)
2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
TL;DR: 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide (CAS 1005666-88-5) is a chemical compound with molecular formula C16H15ClF2N4O3S2 and molecular weight 448.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
Also Known As: 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide, 2-[4-chloro-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide, 2-[4-CHLORO-3-(DIFLUOROMETHYL)-5-METHYL-1H-PYRAZOL-1-YL]-N~1~-[6-(METHYLSULFONYL)-1,3-BENZOTHIAZOL-2-YL]PROPANAMIDE
| Molecular Formula | C16H15ClF2N4O3S2 |
|---|---|
| Molecular Weight | 448.02 g/mol |
| LogP | 3.99542 |
| Topological Polar Surface Area | 93.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.02423 |
| Heavy Atoms | 28 |
| Complexity | 1174.2266 |
Chemical Identifiers
| CAS Number | 1005666-88-5 |
|---|---|
| SMILES | CC1=C(C(=NN1C(C)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)C(F)F)Cl |
Product Overview
2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide (CAS 1005666-88-5), with molecular formula C16H15ClF2N4O3S2 and molecular weight 448.02 g/mol. IUPAC: 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide.
Chemical Property Profile of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
Property Insights of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide
The XLogP value of 3.99542 indicates that 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.95 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide. Following Lipinski's Rule of Five, 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide has 1 hydrogen bond donor(s) and 6 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 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide?
The CAS number of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide is 1005666-88-5.
What is the molecular formula of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide?
The molecular formula of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide is C16H15ClF2N4O3S2.
What is the molecular weight of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide?
The molecular weight of 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide is 448.02 g/mol.
Where can I buy 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide?
You can request a quote for 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-chloro-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.