BAS 01292122
TL;DR: BAS 01292122 (CAS 302802-66-0) is a chemical compound with molecular formula C22H19ClN2O6S and molecular weight 474.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Also Known As: BAS 01292122, AF-399/13427008, dimethyl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, dimethyl 2-({[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, 3,4-dimethyl 2-[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-amido]-4H,5H,6H-cyclopenta[b]thiophene-3,4-dicarboxylate
| Molecular Formula | C22H19ClN2O6S |
|---|---|
| Molecular Weight | 474.07 g/mol |
| LogP | 4.60662 |
| Topological Polar Surface Area | 107.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.06525 |
| Heavy Atoms | 32 |
| Complexity | 1231.2343 |
Chemical Identifiers
| CAS Number | 302802-66-0 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=C(C4=C(S3)CCC4C(=O)OC)C(=O)OC |
Product Overview
BAS 01292122 (CAS 302802-66-0), with molecular formula C22H19ClN2O6S and molecular weight 474.07 g/mol. IUPAC: dimethyl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate.
Chemical Property Profile of BAS 01292122
Property Insights of BAS 01292122
The XLogP value of 4.60662 indicates that BAS 01292122 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 01292122. Following Lipinski's Rule of Five, BAS 01292122 has 1 hydrogen bond donor(s) and 8 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 01292122?
The CAS number of BAS 01292122 is 302802-66-0.
What is the molecular formula of BAS 01292122?
The molecular formula of BAS 01292122 is C22H19ClN2O6S.
What is the molecular weight of BAS 01292122?
The molecular weight of BAS 01292122 is 474.07 g/mol.
Where can I buy BAS 01292122?
You can request a quote for BAS 01292122 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01292122?
Yes, KEHONG BIO provides custom synthesis services for BAS 01292122 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.