N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide
TL;DR: N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide (CAS 851990-02-8) is a chemical compound with molecular formula C16H12F2N2O2S and molecular weight 334.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
Also Known As: UPCMLD0ENAT5456687:001, N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide, N-(2,4-difluorophenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide, N-(2,4-difluorophenyl)-3-(2-oxo(3-hydrobenzothiazol-3-yl))propanamide
| Molecular Formula | C16H12F2N2O2S |
|---|---|
| Molecular Weight | 334.06 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.05875 |
| Heavy Atoms | 23 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 851990-02-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C(=O)S2)CCC(=O)NC3=C(C=C(C=C3)F)F |
| InChIKey | NWDIIYCPXNTIOO-UHFFFAOYSA-N |
Product Overview
N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide (CAS 851990-02-8), with molecular formula C16H12F2N2O2S and molecular weight 334.06 g/mol. IUPAC: N-(2,4-difluorophenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide.
Chemical Property Profile of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide
Property Insights of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide. Following Lipinski's Rule of Five, N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide has 1 hydrogen bond donor(s) and 5 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-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide?
The CAS number of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide is 851990-02-8.
What is the molecular formula of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide?
The molecular formula of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide is C16H12F2N2O2S.
What is the molecular weight of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide?
The molecular weight of N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide is 334.06 g/mol.
Where can I buy N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide?
You can request a quote for N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-difluorophenyl)-3-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.