BIM-0006117.P001
TL;DR: BIM-0006117.P001 (CAS 375836-19-4) is a chemical compound with molecular formula C28H27N5O4 and molecular weight 497.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-1,2-dihydroquinazolin-4-one
Also Known As: BIM-0006117.P001, 3-benzyl-2-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-1,2-dihydroquinazolin-4-one, 3-benzyl-2-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}-2,3-dihydroquinazolin-4(1H)-one, 3-benzyl-2-(3-((3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl)-4-methoxyphenyl)-2,3-dihydroquinazolin-4(1H)-one, 3-BENZYL-2-{3-[(3,5-DIMETHYL-4-NITRO-1H-PYRAZOL-1-YL)METHYL]-4-METHOXYPHENYL}-1,2,3,4-TETRAHYDROQUINAZOLIN-4-ONE
| Molecular Formula | C28H27N5O4 |
|---|---|
| Molecular Weight | 497.21 g/mol |
| LogP | 5.23174 |
| Topological Polar Surface Area | 102.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 497.2063 |
| Heavy Atoms | 37 |
| Complexity | 1481.4332 |
Chemical Identifiers
| CAS Number | 375836-19-4 |
|---|---|
| SMILES | CC1=C(C(=NN1CC2=C(C=CC(=C2)C3NC4=CC=CC=C4C(=O)N3CC5=CC=CC=C5)OC)C)[N+](=O)[O-] |
Product Overview
BIM-0006117.P001 (CAS 375836-19-4), with molecular formula C28H27N5O4 and molecular weight 497.21 g/mol. IUPAC: 3-benzyl-2-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-1,2-dihydroquinazolin-4-one.
Chemical Property Profile of BIM-0006117.P001
Property Insights of BIM-0006117.P001
The XLogP value of 5.23174 indicates that BIM-0006117.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.53 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0006117.P001. Following Lipinski's Rule of Five, BIM-0006117.P001 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0006117.P001?
The CAS number of BIM-0006117.P001 is 375836-19-4.
What is the molecular formula of BIM-0006117.P001?
The molecular formula of BIM-0006117.P001 is C28H27N5O4.
What is the molecular weight of BIM-0006117.P001?
The molecular weight of BIM-0006117.P001 is 497.21 g/mol.
Where can I buy BIM-0006117.P001?
You can request a quote for BIM-0006117.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0006117.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0006117.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.