ChemDiv1_004636
TL;DR: ChemDiv1_004636 (CAS 325693-63-8) is a chemical compound with molecular formula C25H30N4O3S2 and molecular weight 498.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-morpholin-4-ylpropyl)-2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: ChemDiv1_004636, BAS 02072572, AF-399/14202012, F0739-0007, N-(3-morpholin-4-ylpropyl)-2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
| Molecular Formula | C25H30N4O3S2 |
|---|---|
| Molecular Weight | 498.18 g/mol |
| LogP | 3.2566 |
| Topological Polar Surface Area | 76.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.17593 |
| Heavy Atoms | 34 |
| Complexity | 1202.3314 |
Chemical Identifiers
| CAS Number | 325693-63-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)NCCCN5CCOCC5 |
Product Overview
ChemDiv1_004636 (CAS 325693-63-8), with molecular formula C25H30N4O3S2 and molecular weight 498.18 g/mol. IUPAC: N-(3-morpholin-4-ylpropyl)-2-[(4-oxo-3-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_004636
Property Insights of ChemDiv1_004636
The XLogP value of 3.2566 indicates that ChemDiv1_004636 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.46 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004636. Following Lipinski's Rule of Five, ChemDiv1_004636 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_004636?
The CAS number of ChemDiv1_004636 is 325693-63-8.
What is the molecular formula of ChemDiv1_004636?
The molecular formula of ChemDiv1_004636 is C25H30N4O3S2.
What is the molecular weight of ChemDiv1_004636?
The molecular weight of ChemDiv1_004636 is 498.18 g/mol.
Where can I buy ChemDiv1_004636?
You can request a quote for ChemDiv1_004636 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004636?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004636 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.