BAS 00799415
TL;DR: BAS 00799415 (CAS 301680-89-7) is a chemical compound with molecular formula C22H21ClN2O6S and molecular weight 476.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 5-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: BAS 00799415, BIM-0032434.P001, AF-399/37112036, F0901-3726, diethyl 5-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C22H21ClN2O6S |
|---|---|
| Molecular Weight | 476.08 g/mol |
| LogP | 5.27904 |
| Topological Polar Surface Area | 107.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 476.08087 |
| Heavy Atoms | 32 |
| Complexity | 1183.2971 |
Chemical Identifiers
| CAS Number | 301680-89-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=C(ON=C2C3=CC=CC=C3Cl)C |
Product Overview
BAS 00799415 (CAS 301680-89-7), with molecular formula C22H21ClN2O6S and molecular weight 476.08 g/mol. IUPAC: diethyl 5-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of BAS 00799415
Property Insights of BAS 00799415
The XLogP value of 5.27904 indicates that BAS 00799415 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00799415. Following Lipinski's Rule of Five, BAS 00799415 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00799415?
The CAS number of BAS 00799415 is 301680-89-7.
What is the molecular formula of BAS 00799415?
The molecular formula of BAS 00799415 is C22H21ClN2O6S.
What is the molecular weight of BAS 00799415?
The molecular weight of BAS 00799415 is 476.08 g/mol.
Where can I buy BAS 00799415?
You can request a quote for BAS 00799415 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00799415?
Yes, KEHONG BIO provides custom synthesis services for BAS 00799415 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.