BAS 03753981
TL;DR: BAS 03753981 (CAS 433974-03-9) is a chemical compound with molecular formula C22H25NO7S and molecular weight 447.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[4-(4-methoxyphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Also Known As: BAS 03753981, dimethyl 2-{[4-(4-methoxyphenoxy)butanoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, dimethyl 2-(4-(4-methoxyphenoxy)butanamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, dimethyl 2-[4-(4-methoxyphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate, methyl 3-(methoxycarbonyl)-2-[4-(4-methoxyphenoxy)butanoylamino]-4,5,6-trihydr ocyclopenta[3,2-b]thiophene-4-carboxylate
| Molecular Formula | C22H25NO7S |
|---|---|
| Molecular Weight | 447.14 g/mol |
| LogP | 3.5438 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 447.13516 |
| Heavy Atoms | 31 |
| Complexity | 951.51416 |
Chemical Identifiers
| CAS Number | 433974-03-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCCCC(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC |
Product Overview
BAS 03753981 (CAS 433974-03-9), with molecular formula C22H25NO7S and molecular weight 447.14 g/mol. IUPAC: dimethyl 2-[4-(4-methoxyphenoxy)butanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate.
Chemical Property Profile of BAS 03753981
Property Insights of BAS 03753981
The XLogP value of 3.5438 indicates that BAS 03753981 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03753981. Following Lipinski's Rule of Five, BAS 03753981 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 03753981?
The CAS number of BAS 03753981 is 433974-03-9.
What is the molecular formula of BAS 03753981?
The molecular formula of BAS 03753981 is C22H25NO7S.
What is the molecular weight of BAS 03753981?
The molecular weight of BAS 03753981 is 447.14 g/mol.
Where can I buy BAS 03753981?
You can request a quote for BAS 03753981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03753981?
Yes, KEHONG BIO provides custom synthesis services for BAS 03753981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.