BAS 00316644
TL;DR: BAS 00316644 (CAS 311795-33-2) is a chemical compound with molecular formula C29H29NO4 and molecular weight 455.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-ethoxyphenyl] acetate
Also Known As: BAS 00316644, 4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-ethoxyphenyl acetate, A1561/0068038, [4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-ethoxyphenyl] acetate, 4-{2,2-DIMETHYL-4-OXO-1H,2H,3H,4H,5H,6H-BENZO[A]PHENANTHRIDIN-5-YL}-2-ETHOXYPHENYL ACETATE
| Molecular Formula | C29H29NO4 |
|---|---|
| Molecular Weight | 455.21 g/mol |
| LogP | 6.4733 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 455.20966 |
| Heavy Atoms | 34 |
| Complexity | 1351.4928 |
Chemical Identifiers
| CAS Number | 311795-33-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)OC(=O)C |
Product Overview
BAS 00316644 (CAS 311795-33-2), with molecular formula C29H29NO4 and molecular weight 455.21 g/mol. IUPAC: [4-(2,2-dimethyl-4-oxo-1,3,5,6-tetrahydrobenzo[a]phenanthridin-5-yl)-2-ethoxyphenyl] acetate.
Chemical Property Profile of BAS 00316644
Property Insights of BAS 00316644
The XLogP value of 6.4733 indicates that BAS 00316644 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00316644. Following Lipinski's Rule of Five, BAS 00316644 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00316644?
The CAS number of BAS 00316644 is 311795-33-2.
What is the molecular formula of BAS 00316644?
The molecular formula of BAS 00316644 is C29H29NO4.
What is the molecular weight of BAS 00316644?
The molecular weight of BAS 00316644 is 455.21 g/mol.
Where can I buy BAS 00316644?
You can request a quote for BAS 00316644 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00316644?
Yes, KEHONG BIO provides custom synthesis services for BAS 00316644 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.