ChemDiv1_009503
TL;DR: ChemDiv1_009503 (CAS 312311-49-2) is a chemical compound with molecular formula C26H23N5O5 and molecular weight 485.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-3-(4-methoxyphenyl)-1,2-dihydroquinazolin-4-one
Also Known As: ChemDiv1_009503, 2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-3-(4-methoxyphenyl)-1,2-dihydroquinazolin-4-one, AJ-292/15008486, 2-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-3-(4-methoxyphenyl)-2,3-dihydroquinazolin-4(1H)-one, 2-[3-({4-nitro-1H-pyrazol-1-yl}methyl)-4-methoxyphenyl]-3-(4-methoxyphenyl)-2,3-dihydro-4(1H)-quinazolinone
| Molecular Formula | C26H23N5O5 |
|---|---|
| Molecular Weight | 485.17 g/mol |
| LogP | 4.6279 |
| Topological Polar Surface Area | 111.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.16992 |
| Heavy Atoms | 36 |
| Complexity | 1432.9279 |
Chemical Identifiers
| CAS Number | 312311-49-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)CN5C=C(C=N5)[N+](=O)[O-] |
Product Overview
ChemDiv1_009503 (CAS 312311-49-2), with molecular formula C26H23N5O5 and molecular weight 485.17 g/mol. IUPAC: 2-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]-3-(4-methoxyphenyl)-1,2-dihydroquinazolin-4-one.
Chemical Property Profile of ChemDiv1_009503
Property Insights of ChemDiv1_009503
The XLogP value of 4.6279 indicates that ChemDiv1_009503 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009503. Following Lipinski's Rule of Five, ChemDiv1_009503 has 1 hydrogen bond donor(s) and 7 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 ChemDiv1_009503?
The CAS number of ChemDiv1_009503 is 312311-49-2.
What is the molecular formula of ChemDiv1_009503?
The molecular formula of ChemDiv1_009503 is C26H23N5O5.
What is the molecular weight of ChemDiv1_009503?
The molecular weight of ChemDiv1_009503 is 485.17 g/mol.
Where can I buy ChemDiv1_009503?
You can request a quote for ChemDiv1_009503 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009503?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009503 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.