BIM-0041858.P001
TL;DR: BIM-0041858.P001 (CAS 329066-74-2) is a chemical compound with molecular formula C23H22N2O4S and molecular weight 422.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid
Also Known As: BIM-0041858.P001, 4-({3-[(1-naphthylamino)carbonyl]-4,5,6,7-tetrahydro-1-benzothien-2-yl}amino)-4-oxobutanoic acid, 4-[[3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid, 3-{N-[3-(N-naphthylcarbamoyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl]carbamoy l}propanoic acid, 4-((3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)amino)-4-oxobutanoic acid
| Molecular Formula | C23H22N2O4S |
|---|---|
| Molecular Weight | 422.13 g/mol |
| LogP | 4.8357 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.13004 |
| Heavy Atoms | 30 |
| Complexity | 1130.1836 |
Chemical Identifiers
| CAS Number | 329066-74-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)CCC(=O)O)C(=O)NC3=CC=CC4=CC=CC=C43 |
Product Overview
BIM-0041858.P001 (CAS 329066-74-2), with molecular formula C23H22N2O4S and molecular weight 422.13 g/mol. IUPAC: 4-[[3-(naphthalen-1-ylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobutanoic acid.
Chemical Property Profile of BIM-0041858.P001
Property Insights of BIM-0041858.P001
The XLogP value of 4.8357 indicates that BIM-0041858.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0041858.P001. Following Lipinski's Rule of Five, BIM-0041858.P001 has 3 hydrogen bond donor(s) and 4 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 BIM-0041858.P001?
The CAS number of BIM-0041858.P001 is 329066-74-2.
What is the molecular formula of BIM-0041858.P001?
The molecular formula of BIM-0041858.P001 is C23H22N2O4S.
What is the molecular weight of BIM-0041858.P001?
The molecular weight of BIM-0041858.P001 is 422.13 g/mol.
Where can I buy BIM-0041858.P001?
You can request a quote for BIM-0041858.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0041858.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0041858.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.