ChemDiv1_019177
TL;DR: ChemDiv1_019177 (CAS 180984-70-7) is a chemical compound with molecular formula C25H23NO3 and molecular weight 385.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dihydroxyphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one
Also Known As: ChemDiv1_019177, BAS 00432211, 5-(3,4-dihydroxyphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one, 5-(3,4-dihydroxyphenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one, 5-(3,4-DIHYDROXYPHENYL)-2,2-DIMETHYL-1H,2H,3H,4H,5H,6H-BENZO[A]PHENANTHRIDIN-4-ONE
| Molecular Formula | C25H23NO3 |
|---|---|
| Molecular Weight | 385.17 g/mol |
| LogP | 5.5605 |
| Topological Polar Surface Area | 69.56 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 385.1678 |
| Heavy Atoms | 29 |
| Complexity | 1205.9141 |
Chemical Identifiers
| CAS Number | 180984-70-7 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=C(C=C5)O)O)C(=O)C1)C |
Product Overview
ChemDiv1_019177 (CAS 180984-70-7), with molecular formula C25H23NO3 and molecular weight 385.17 g/mol. IUPAC: 5-(3,4-dihydroxyphenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one.
Chemical Property Profile of ChemDiv1_019177
Property Insights of ChemDiv1_019177
The XLogP value of 5.5605 indicates that ChemDiv1_019177 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.56 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_019177. Following Lipinski's Rule of Five, ChemDiv1_019177 has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_019177?
The CAS number of ChemDiv1_019177 is 180984-70-7.
What is the molecular formula of ChemDiv1_019177?
The molecular formula of ChemDiv1_019177 is C25H23NO3.
What is the molecular weight of ChemDiv1_019177?
The molecular weight of ChemDiv1_019177 is 385.17 g/mol.
Where can I buy ChemDiv1_019177?
You can request a quote for ChemDiv1_019177 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019177?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019177 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.