BAS 00915554
TL;DR: BAS 00915554 (CAS 312697-76-0) is a chemical compound with molecular formula C21H23FN2O4S and molecular weight 418.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-fluorobenzoyl)amino]-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylate
Also Known As: BAS 00915554, AB00096822-01, ETHYL 2-(4-FLUOROBENZAMIDO)-4-METHYL-5-(PIPERIDINE-1-CARBONYL)THIOPHENE-3-CARBOXYLATE, ETHYL 2-[(4-FLUOROBENZOYL)AMINO]-4-METHYL-5-(1-PIPERIDINYLCARBONYL)-3-THIOPHENECARBOXYLATE, ethyl 2-[(4-fluorobenzene)amido]-4-methyl-5-(piperidin-1-ylcarbonyl)thiophene-3-carboxylate
| Molecular Formula | C21H23FN2O4S |
|---|---|
| Molecular Weight | 418.14 g/mol |
| LogP | 4.25072 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.13626 |
| Heavy Atoms | 29 |
| Complexity | 917.50745 |
Chemical Identifiers
| CAS Number | 312697-76-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)F |
Product Overview
BAS 00915554 (CAS 312697-76-0), with molecular formula C21H23FN2O4S and molecular weight 418.14 g/mol. IUPAC: ethyl 2-[(4-fluorobenzoyl)amino]-4-methyl-5-(piperidine-1-carbonyl)thiophene-3-carboxylate.
Chemical Property Profile of BAS 00915554
Property Insights of BAS 00915554
The XLogP value of 4.25072 indicates that BAS 00915554 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00915554. Following Lipinski's Rule of Five, BAS 00915554 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 00915554?
The CAS number of BAS 00915554 is 312697-76-0.
What is the molecular formula of BAS 00915554?
The molecular formula of BAS 00915554 is C21H23FN2O4S.
What is the molecular weight of BAS 00915554?
The molecular weight of BAS 00915554 is 418.14 g/mol.
Where can I buy BAS 00915554?
You can request a quote for BAS 00915554 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00915554?
Yes, KEHONG BIO provides custom synthesis services for BAS 00915554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.