ChemDiv3_003889
TL;DR: ChemDiv3_003889 (CAS 684228-13-5) is a chemical compound with molecular formula C24H31N3O2 and molecular weight 393.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)-1-[3-(4-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one
Also Known As: ChemDiv3_003889, IDI1_021799, 3-(diethylamino)-1-[5-(4-methoxyphenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one, BRD-A46737973-001-01-1, F1138-0109
| Molecular Formula | C24H31N3O2 |
|---|---|
| Molecular Weight | 393.24 g/mol |
| LogP | 4.41322 |
| Topological Polar Surface Area | 45.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 393.24164 |
| Heavy Atoms | 29 |
| Complexity | 839.43445 |
Chemical Identifiers
| CAS Number | 684228-13-5 |
|---|---|
| SMILES | CCN(CC)CCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)OC |
Product Overview
ChemDiv3_003889 (CAS 684228-13-5), with molecular formula C24H31N3O2 and molecular weight 393.24 g/mol. IUPAC: 3-(diethylamino)-1-[3-(4-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]propan-1-one.
Chemical Property Profile of ChemDiv3_003889
Property Insights of ChemDiv3_003889
The XLogP value of 4.41322 indicates that ChemDiv3_003889 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.14 Ų, ChemDiv3_003889 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003889 has 0 hydrogen bond donor(s) and 4 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_003889?
The CAS number of ChemDiv3_003889 is 684228-13-5.
What is the molecular formula of ChemDiv3_003889?
The molecular formula of ChemDiv3_003889 is C24H31N3O2.
What is the molecular weight of ChemDiv3_003889?
The molecular weight of ChemDiv3_003889 is 393.24 g/mol.
Where can I buy ChemDiv3_003889?
You can request a quote for ChemDiv3_003889 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003889?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003889 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.