BIM-0038242.P001
TL;DR: BIM-0038242.P001 (CAS 372154-97-7) is a chemical compound with molecular formula C26H25N3O4S2 and molecular weight 507.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[11-benzyl-4-(4-methoxyphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate
Also Known As: BIM-0038242.P001, methyl {[7-benzyl-3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate, methyl 2-((7-benzyl-3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetate, methyl 2-[[7-benzyl-3-(4-methoxyphenyl)-4-oxo-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl]sulfanyl]acetate
| Molecular Formula | C26H25N3O4S2 |
|---|---|
| Molecular Weight | 507.13 g/mol |
| LogP | 4.2792 |
| Topological Polar Surface Area | 73.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 507.12866 |
| Heavy Atoms | 35 |
| Complexity | 1414.8087 |
Chemical Identifiers
| CAS Number | 372154-97-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)OC)SC4=C3CCN(C4)CC5=CC=CC=C5 |
Product Overview
BIM-0038242.P001 (CAS 372154-97-7), with molecular formula C26H25N3O4S2 and molecular weight 507.13 g/mol. IUPAC: methyl 2-[[11-benzyl-4-(4-methoxyphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate.
Chemical Property Profile of BIM-0038242.P001
Property Insights of BIM-0038242.P001
The XLogP value of 4.2792 indicates that BIM-0038242.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0038242.P001. Following Lipinski's Rule of Five, BIM-0038242.P001 has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0038242.P001?
The CAS number of BIM-0038242.P001 is 372154-97-7.
What is the molecular formula of BIM-0038242.P001?
The molecular formula of BIM-0038242.P001 is C26H25N3O4S2.
What is the molecular weight of BIM-0038242.P001?
The molecular weight of BIM-0038242.P001 is 507.13 g/mol.
Where can I buy BIM-0038242.P001?
You can request a quote for BIM-0038242.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0038242.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0038242.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.