BIM-0038180.P001
TL;DR: BIM-0038180.P001 (CAS 325476-18-4) is a chemical compound with molecular formula C32H26N4O4S and molecular weight 562.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[5-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzoate
Also Known As: BIM-0038180.P001, F0464-0010, methyl 4-(((5-(3-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)methyl)benzoate, methyl 4-({[5-(3-{2,4-dioxo-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaen-3-yl}propyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzoate, methyl 4-[[5-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzoate
| Molecular Formula | C32H26N4O4S |
|---|---|
| Molecular Weight | 562.17 g/mol |
| LogP | 5.7282 |
| Topological Polar Surface Area | 94.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 562.1675 |
| Heavy Atoms | 41 |
| Complexity | 1715.6217 |
Chemical Identifiers
| CAS Number | 325476-18-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CCCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O |
Product Overview
BIM-0038180.P001 (CAS 325476-18-4), with molecular formula C32H26N4O4S and molecular weight 562.17 g/mol. IUPAC: methyl 4-[[5-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzoate.
Chemical Property Profile of BIM-0038180.P001
Property Insights of BIM-0038180.P001
The XLogP value of 5.7282 indicates that BIM-0038180.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0038180.P001. Following Lipinski's Rule of Five, BIM-0038180.P001 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0038180.P001?
The CAS number of BIM-0038180.P001 is 325476-18-4.
What is the molecular formula of BIM-0038180.P001?
The molecular formula of BIM-0038180.P001 is C32H26N4O4S.
What is the molecular weight of BIM-0038180.P001?
The molecular weight of BIM-0038180.P001 is 562.17 g/mol.
Where can I buy BIM-0038180.P001?
You can request a quote for BIM-0038180.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0038180.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0038180.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.