ChemDiv1_021478
TL;DR: ChemDiv1_021478 (CAS 317323-95-8) is a chemical compound with molecular formula C32H29NO2 and molecular weight 459.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-5-(4-phenylmethoxyphenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one
Also Known As: ChemDiv1_021478, BAS 00457654, 2,2-dimethyl-5-(4-phenylmethoxyphenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one, 5-[4-(benzyloxy)phenyl]-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one, 5-(4-(benzyloxy)phenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
| Molecular Formula | C32H29NO2 |
|---|---|
| Molecular Weight | 459.22 g/mol |
| LogP | 7.7283 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 459.21982 |
| Heavy Atoms | 35 |
| Complexity | 1448.4409 |
Chemical Identifiers
| CAS Number | 317323-95-8 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC=C(C=C5)OCC6=CC=CC=C6)C(=O)C1)C |
Product Overview
ChemDiv1_021478 (CAS 317323-95-8), with molecular formula C32H29NO2 and molecular weight 459.22 g/mol. IUPAC: 2,2-dimethyl-5-(4-phenylmethoxyphenyl)-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one.
Chemical Property Profile of ChemDiv1_021478
Property Insights of ChemDiv1_021478
The XLogP value of 7.7283 indicates that ChemDiv1_021478 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, ChemDiv1_021478 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_021478 has 1 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_021478?
The CAS number of ChemDiv1_021478 is 317323-95-8.
What is the molecular formula of ChemDiv1_021478?
The molecular formula of ChemDiv1_021478 is C32H29NO2.
What is the molecular weight of ChemDiv1_021478?
The molecular weight of ChemDiv1_021478 is 459.22 g/mol.
Where can I buy ChemDiv1_021478?
You can request a quote for ChemDiv1_021478 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021478?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021478 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.