BAS 05277639
TL;DR: BAS 05277639 (CAS 445016-86-4) is a chemical compound with molecular formula C18H17N3O2S and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-oxazole-4-carboxamide
Also Known As: BAS 05277639, 5-methyl-3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-oxazole-4-carboxamide, 5-methyl-3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-isoxazolecarboxamide, 5-methyl-3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)isoxazole-4-carboxamide
| Molecular Formula | C18H17N3O2S |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.10416 |
| Heavy Atoms | 24 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 445016-86-4 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=NC4=C(S3)CCCC4 |
| InChIKey | RQJLDSHSQPYIBG-UHFFFAOYSA-N |
Product Overview
BAS 05277639 (CAS 445016-86-4), with molecular formula C18H17N3O2S and molecular weight 339.10 g/mol. IUPAC: 5-methyl-3-phenyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1,2-oxazole-4-carboxamide.
Chemical Property Profile of BAS 05277639
Property Insights of BAS 05277639
The XLogP value of 3.7 indicates that BAS 05277639 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05277639. Following Lipinski's Rule of Five, BAS 05277639 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 BAS 05277639?
The CAS number of BAS 05277639 is 445016-86-4.
What is the molecular formula of BAS 05277639?
The molecular formula of BAS 05277639 is C18H17N3O2S.
What is the molecular weight of BAS 05277639?
The molecular weight of BAS 05277639 is 339.10 g/mol.
Where can I buy BAS 05277639?
You can request a quote for BAS 05277639 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05277639?
Yes, KEHONG BIO provides custom synthesis services for BAS 05277639 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.