ChemDiv1_021888
TL;DR: ChemDiv1_021888 (CAS 312938-30-0) is a chemical compound with molecular formula C31H32N4O3 and molecular weight 508.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-3-oxo-1-(4-propan-2-ylphenyl)prop-1-en-2-yl]-4-methylbenzamide
Also Known As: ChemDiv1_021888, N-[(Z)-1-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]carbonyl}-2-(4-isopropylphenyl)ethenyl]-4-methylbenzamide, (2Z)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(4-methylphenyl)formamido]-3-[4-(propan-2-yl)phenyl]prop-2-enamide, 651-623-5, N-((Z)-1-(((1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL)AMINO)CARBONYL)-2-(4-ISOPROPYLPHENYL)ETHENYL)-4-METHYLBENZAMIDE
| Molecular Formula | C31H32N4O3 |
|---|---|
| Molecular Weight | 508.25 g/mol |
| LogP | 5.32584 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 508.24744 |
| Heavy Atoms | 38 |
| Complexity | 1541.915 |
Chemical Identifiers
| CAS Number | 312938-30-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)C(C)C)/C(=O)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C |
Product Overview
ChemDiv1_021888 (CAS 312938-30-0), with molecular formula C31H32N4O3 and molecular weight 508.25 g/mol. IUPAC: N-[(Z)-3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-3-oxo-1-(4-propan-2-ylphenyl)prop-1-en-2-yl]-4-methylbenzamide.
Chemical Property Profile of ChemDiv1_021888
Property Insights of ChemDiv1_021888
The XLogP value of 5.32584 indicates that ChemDiv1_021888 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_021888. Following Lipinski's Rule of Five, ChemDiv1_021888 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_021888?
The CAS number of ChemDiv1_021888 is 312938-30-0.
What is the molecular formula of ChemDiv1_021888?
The molecular formula of ChemDiv1_021888 is C31H32N4O3.
What is the molecular weight of ChemDiv1_021888?
The molecular weight of ChemDiv1_021888 is 508.25 g/mol.
Where can I buy ChemDiv1_021888?
You can request a quote for ChemDiv1_021888 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021888?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021888 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.