ChemDiv3_007885
TL;DR: ChemDiv3_007885 (CAS 686770-14-9) is a chemical compound with molecular formula C23H21N3O2S2 and molecular weight 435.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
Also Known As: ChemDiv3_007885, IDI1_025795, BRD-K48652257-001-01-5, F0579-0010, 2-((2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one
| Molecular Formula | C23H21N3O2S2 |
|---|---|
| Molecular Weight | 435.11 g/mol |
| LogP | 3.9522 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.1075 |
| Heavy Atoms | 30 |
| Complexity | 1160.855 |
Chemical Identifiers
| CAS Number | 686770-14-9 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)CSC3=NC4=C(C(=O)N3C5=CC=CC=C5)SCC4 |
Product Overview
ChemDiv3_007885 (CAS 686770-14-9), with molecular formula C23H21N3O2S2 and molecular weight 435.11 g/mol. IUPAC: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of ChemDiv3_007885
Property Insights of ChemDiv3_007885
The XLogP value of 3.9522 indicates that ChemDiv3_007885 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, ChemDiv3_007885 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_007885 has 0 hydrogen bond donor(s) and 5 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 ChemDiv3_007885?
The CAS number of ChemDiv3_007885 is 686770-14-9.
What is the molecular formula of ChemDiv3_007885?
The molecular formula of ChemDiv3_007885 is C23H21N3O2S2.
What is the molecular weight of ChemDiv3_007885?
The molecular weight of ChemDiv3_007885 is 435.11 g/mol.
Where can I buy ChemDiv3_007885?
You can request a quote for ChemDiv3_007885 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_007885?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_007885 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.