ChemDiv2_004874
TL;DR: ChemDiv2_004874 (CAS 843629-91-4) is a chemical compound with molecular formula C23H25N3O2 and molecular weight 375.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-(2-hydroxyethylamino)-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one
Also Known As: ChemDiv2_004874, IDI1_003589, 5-Ethyl-2-((2-hydroxyethyl)amino)-5-methyl-3-phenyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one, 5-ethyl-2-(2-hydroxyethylamino)-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one, 5-ethyl-2-[(2-hydroxyethyl)amino]-5-methyl-3-phenyl-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
| Molecular Formula | C23H25N3O2 |
|---|---|
| Molecular Weight | 375.19 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.19467 |
| Heavy Atoms | 28 |
| Complexity | 665.0 |
Chemical Identifiers
| CAS Number | 843629-91-4 |
|---|---|
| SMILES | CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)NCCO)C4=CC=CC=C4)C |
| InChIKey | XDIJFTWBSBJILS-UHFFFAOYSA-N |
Product Overview
ChemDiv2_004874 (CAS 843629-91-4), with molecular formula C23H25N3O2 and molecular weight 375.19 g/mol. IUPAC: 5-ethyl-2-(2-hydroxyethylamino)-5-methyl-3-phenyl-6H-benzo[h]quinazolin-4-one.
Chemical Property Profile of ChemDiv2_004874
Property Insights of ChemDiv2_004874
The XLogP value of 3.5 indicates that ChemDiv2_004874 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_004874. Following Lipinski's Rule of Five, ChemDiv2_004874 has 2 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_004874?
The CAS number of ChemDiv2_004874 is 843629-91-4.
What is the molecular formula of ChemDiv2_004874?
The molecular formula of ChemDiv2_004874 is C23H25N3O2.
What is the molecular weight of ChemDiv2_004874?
The molecular weight of ChemDiv2_004874 is 375.19 g/mol.
Where can I buy ChemDiv2_004874?
You can request a quote for ChemDiv2_004874 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004874?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004874 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.