BIM-0044373.P001
TL;DR: BIM-0044373.P001 (CAS 330827-30-0) is a chemical compound with molecular formula C29H33N3O2S and molecular weight 487.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(4-benzylpiperazine-1-carbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide
Also Known As: BIM-0044373.P001, N-[3-(4-benzylpiperazine-1-carbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide, N-{3-[(4-benzylpiperazin-1-yl)carbonyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-2-methylbenzamide, (2-methylphenyl)-N-(6-methyl-3-{[4-benzylpiperazinyl]carbonyl}(4,5,6,7-tetrahy drobenzo[b]thiophen-2-yl))carboxamide, N-{3-[(4-benzyl-1-piperazinyl)carbonyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothien-2-yl}-2-methylbenzamide
| Molecular Formula | C29H33N3O2S |
|---|---|
| Molecular Weight | 487.23 g/mol |
| LogP | 5.39162 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 487.22934 |
| Heavy Atoms | 35 |
| Complexity | 1211.9198 |
Chemical Identifiers
| CAS Number | 330827-30-0 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5C |
Product Overview
BIM-0044373.P001 (CAS 330827-30-0), with molecular formula C29H33N3O2S and molecular weight 487.23 g/mol. IUPAC: N-[3-(4-benzylpiperazine-1-carbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylbenzamide.
Chemical Property Profile of BIM-0044373.P001
Property Insights of BIM-0044373.P001
The XLogP value of 5.39162 indicates that BIM-0044373.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.65 Ų, BIM-0044373.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0044373.P001 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0044373.P001?
The CAS number of BIM-0044373.P001 is 330827-30-0.
What is the molecular formula of BIM-0044373.P001?
The molecular formula of BIM-0044373.P001 is C29H33N3O2S.
What is the molecular weight of BIM-0044373.P001?
The molecular weight of BIM-0044373.P001 is 487.23 g/mol.
Where can I buy BIM-0044373.P001?
You can request a quote for BIM-0044373.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0044373.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0044373.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.