3-Isobutyrylamino-N-thiazol-2-yl-benzamide
TL;DR: 3-Isobutyrylamino-N-thiazol-2-yl-benzamide (CAS 599189-37-4) is a chemical compound with molecular formula C14H15N3O2S and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylpropanoylamino)-N-(1,3-thiazol-2-yl)benzamide
Also Known As: BAS 05602277, 3-Isobutyrylamino-N-thiazol-2-yl-benzamide, 3-[(2-methylpropanoyl)amino]-N-(1,3-thiazol-2-yl)benzamide, 3-(2-methylpropanoylamino)-N-(1,3-thiazol-2-yl)benzamide, 2-methyl-N-[3-(N-(1,3-thiazol-2-yl)carbamoyl)phenyl]propanamide
| Molecular Formula | C14H15N3O2S |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.0885 |
| Heavy Atoms | 20 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 599189-37-4 |
|---|---|
| SMILES | CC(C)C(=O)NC1=CC=CC(=C1)C(=O)NC2=NC=CS2 |
| InChIKey | KVQSCQLHCYORDT-UHFFFAOYSA-N |
Product Overview
3-Isobutyrylamino-N-thiazol-2-yl-benzamide (CAS 599189-37-4), with molecular formula C14H15N3O2S and molecular weight 289.09 g/mol. IUPAC: 3-(2-methylpropanoylamino)-N-(1,3-thiazol-2-yl)benzamide.
Chemical Property Profile of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide
Property Insights of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isobutyrylamino-N-thiazol-2-yl-benzamide. The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Isobutyrylamino-N-thiazol-2-yl-benzamide. Following Lipinski's Rule of Five, 3-Isobutyrylamino-N-thiazol-2-yl-benzamide has 2 hydrogen bond donor(s) and 4 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 3-Isobutyrylamino-N-thiazol-2-yl-benzamide?
The CAS number of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide is 599189-37-4.
What is the molecular formula of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide?
The molecular formula of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide is C14H15N3O2S.
What is the molecular weight of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide?
The molecular weight of 3-Isobutyrylamino-N-thiazol-2-yl-benzamide is 289.09 g/mol.
Where can I buy 3-Isobutyrylamino-N-thiazol-2-yl-benzamide?
You can request a quote for 3-Isobutyrylamino-N-thiazol-2-yl-benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Isobutyrylamino-N-thiazol-2-yl-benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Isobutyrylamino-N-thiazol-2-yl-benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.