ChemDiv1_003693
TL;DR: ChemDiv1_003693 (CAS 312627-15-9) is a chemical compound with molecular formula C24H25N3O2S and molecular weight 419.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-3-propyl-1,2-dihydroquinazolin-4-one
Also Known As: ChemDiv1_003693, BIM-0006232.P001, 2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-3-propyl-1,2-dihydroquinazolin-4-one, 2-[4-Methoxy-3-(pyridin-2-ylsulfanylmethyl)-phenyl]-3-propyl-2,3-dihydro-1H-quinazolin-4-one, 2-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]phenyl}-3-propyl-2,3-dihydroquinazolin-4(1H)-one
| Molecular Formula | C24H25N3O2S |
|---|---|
| Molecular Weight | 419.17 g/mol |
| LogP | 5.359 |
| Topological Polar Surface Area | 54.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 419.16675 |
| Heavy Atoms | 30 |
| Complexity | 1025.9695 |
Chemical Identifiers
| CAS Number | 312627-15-9 |
|---|---|
| SMILES | CCCN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)CSC4=CC=CC=N4 |
Product Overview
ChemDiv1_003693 (CAS 312627-15-9), with molecular formula C24H25N3O2S and molecular weight 419.17 g/mol. IUPAC: 2-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-3-propyl-1,2-dihydroquinazolin-4-one.
Chemical Property Profile of ChemDiv1_003693
Property Insights of ChemDiv1_003693
The XLogP value of 5.359 indicates that ChemDiv1_003693 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.46 Ų, ChemDiv1_003693 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_003693 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_003693?
The CAS number of ChemDiv1_003693 is 312627-15-9.
What is the molecular formula of ChemDiv1_003693?
The molecular formula of ChemDiv1_003693 is C24H25N3O2S.
What is the molecular weight of ChemDiv1_003693?
The molecular weight of ChemDiv1_003693 is 419.17 g/mol.
Where can I buy ChemDiv1_003693?
You can request a quote for ChemDiv1_003693 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_003693?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_003693 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.