BIM-0005878.P001
TL;DR: BIM-0005878.P001 (CAS 375839-53-5) is a chemical compound with molecular formula C29H25N3O5 and molecular weight 495.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,2-dihydroquinazolin-4-one
Also Known As: BIM-0005878.P001, 3-benzyl-2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,2-dihydroquinazolin-4-one, 3-benzyl-2-{4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl}-2,3-dihydroquinazolin-4(1H)-one, 3-benzyl-2-(4-methoxy-3-((4-nitrophenoxy)methyl)phenyl)-2,3-dihydroquinazolin-4(1H)-one
| Molecular Formula | C29H25N3O5 |
|---|---|
| Molecular Weight | 495.18 g/mol |
| LogP | 5.9491 |
| Topological Polar Surface Area | 93.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 495.1794 |
| Heavy Atoms | 37 |
| Complexity | 1423.4232 |
Chemical Identifiers
| CAS Number | 375839-53-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)COC5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
BIM-0005878.P001 (CAS 375839-53-5), with molecular formula C29H25N3O5 and molecular weight 495.18 g/mol. IUPAC: 3-benzyl-2-[4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl]-1,2-dihydroquinazolin-4-one.
Chemical Property Profile of BIM-0005878.P001
Property Insights of BIM-0005878.P001
The XLogP value of 5.9491 indicates that BIM-0005878.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0005878.P001. Following Lipinski's Rule of Five, BIM-0005878.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-0005878.P001?
The CAS number of BIM-0005878.P001 is 375839-53-5.
What is the molecular formula of BIM-0005878.P001?
The molecular formula of BIM-0005878.P001 is C29H25N3O5.
What is the molecular weight of BIM-0005878.P001?
The molecular weight of BIM-0005878.P001 is 495.18 g/mol.
Where can I buy BIM-0005878.P001?
You can request a quote for BIM-0005878.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0005878.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0005878.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.