ChemDiv1_025184
TL;DR: ChemDiv1_025184 (CAS 312269-87-7) is a chemical compound with molecular formula C30H31NO5 and molecular weight 485.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate
Also Known As: ChemDiv1_025184, BAS 00442774, ethyl [4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate, A1099/0051641, ethyl 2-[4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate
| Molecular Formula | C30H31NO5 |
|---|---|
| Molecular Weight | 485.22 g/mol |
| LogP | 6.0998 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.2202 |
| Heavy Atoms | 36 |
| Complexity | 1387.3497 |
Chemical Identifiers
| CAS Number | 312269-87-7 |
|---|---|
| SMILES | CCOC(=O)COC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)OC |
Product Overview
ChemDiv1_025184 (CAS 312269-87-7), with molecular formula C30H31NO5 and molecular weight 485.22 g/mol. IUPAC: ethyl 2-[4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]acetate.
Chemical Property Profile of ChemDiv1_025184
Property Insights of ChemDiv1_025184
The XLogP value of 6.0998 indicates that ChemDiv1_025184 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_025184. Following Lipinski's Rule of Five, ChemDiv1_025184 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 ChemDiv1_025184?
The CAS number of ChemDiv1_025184 is 312269-87-7.
What is the molecular formula of ChemDiv1_025184?
The molecular formula of ChemDiv1_025184 is C30H31NO5.
What is the molecular weight of ChemDiv1_025184?
The molecular weight of ChemDiv1_025184 is 485.22 g/mol.
Where can I buy ChemDiv1_025184?
You can request a quote for ChemDiv1_025184 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_025184?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_025184 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.