BAS 01833642
TL;DR: BAS 01833642 (CAS 303033-09-2) is a chemical compound with molecular formula C21H23NO6S and molecular weight 417.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Also Known As: BAS 01833642, BIM-0030459.P001, dimethyl 2-[(4-phenoxybutanoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, dimethyl 2-(4-phenoxybutanamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, dimethyl 2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
| Molecular Formula | C21H23NO6S |
|---|---|
| Molecular Weight | 417.12 g/mol |
| LogP | 3.5352 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 417.1246 |
| Heavy Atoms | 29 |
| Complexity | 892.0763 |
Chemical Identifiers
| CAS Number | 303033-09-2 |
|---|---|
| SMILES | COC(=O)C1CCC2=C1C(=C(S2)NC(=O)CCCOC3=CC=CC=C3)C(=O)OC |
Product Overview
BAS 01833642 (CAS 303033-09-2), with molecular formula C21H23NO6S and molecular weight 417.12 g/mol. IUPAC: dimethyl 2-(4-phenoxybutanoylamino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate.
Chemical Property Profile of BAS 01833642
Property Insights of BAS 01833642
The XLogP value of 3.5352 indicates that BAS 01833642 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01833642. Following Lipinski's Rule of Five, BAS 01833642 has 1 hydrogen bond donor(s) and 7 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 01833642?
The CAS number of BAS 01833642 is 303033-09-2.
What is the molecular formula of BAS 01833642?
The molecular formula of BAS 01833642 is C21H23NO6S.
What is the molecular weight of BAS 01833642?
The molecular weight of BAS 01833642 is 417.12 g/mol.
Where can I buy BAS 01833642?
You can request a quote for BAS 01833642 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01833642?
Yes, KEHONG BIO provides custom synthesis services for BAS 01833642 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.