ChemDiv2_007035
TL;DR: ChemDiv2_007035 (CAS 847398-32-7) is a chemical compound with molecular formula C19H16ClN3O2 and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-6-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyrimidine-2,4-dione
Also Known As: ChemDiv2_007035, IDI1_005750, F0662-0166, 3-(2-chlorophenyl)-6-(3,4-dihydroisoquinolin-2(1H)-yl)pyrimidine-2,4(1H,3H)-dione, 3-(2-chlorophenyl)-6-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyrimidine-2,4-dione
| Molecular Formula | C19H16ClN3O2 |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 2.7419 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.0931 |
| Heavy Atoms | 25 |
| Complexity | 1023.52515 |
Chemical Identifiers
| CAS Number | 847398-32-7 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C3=CC(=O)N(C(=O)N3)C4=CC=CC=C4Cl |
Product Overview
ChemDiv2_007035 (CAS 847398-32-7), with molecular formula C19H16ClN3O2 and molecular weight 353.09 g/mol. IUPAC: 3-(2-chlorophenyl)-6-(3,4-dihydro-1H-isoquinolin-2-yl)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of ChemDiv2_007035
Property Insights of ChemDiv2_007035
The XLogP value of 2.7419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_007035. With a topological polar surface area (TPSA) of 58.1 Ų, ChemDiv2_007035 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_007035 has 1 hydrogen bond donor(s) and 3 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 ChemDiv2_007035?
The CAS number of ChemDiv2_007035 is 847398-32-7.
What is the molecular formula of ChemDiv2_007035?
The molecular formula of ChemDiv2_007035 is C19H16ClN3O2.
What is the molecular weight of ChemDiv2_007035?
The molecular weight of ChemDiv2_007035 is 353.09 g/mol.
Where can I buy ChemDiv2_007035?
You can request a quote for ChemDiv2_007035 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_007035?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_007035 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.