BAS 00457518
TL;DR: BAS 00457518 (CAS 22949-38-8) is a chemical compound with molecular formula C25H22ClNO and molecular weight 387.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3-chlorophenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one
Also Known As: BAS 00457518, 5-(3-chlorophenyl)-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one, A0457/0021123, 5-(3-chlorophenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one, 5-(3-CHLOROPHENYL)-2,2-DIMETHYL-1H,2H,3H,4H,5H,6H-BENZO[A]PHENANTHRIDIN-4-ONE
| Molecular Formula | C25H22ClNO |
|---|---|
| Molecular Weight | 387.14 g/mol |
| LogP | 6.8027 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 387.13898 |
| Heavy Atoms | 28 |
| Complexity | 1158.1765 |
Chemical Identifiers
| CAS Number | 22949-38-8 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C2C4=CC=CC=C4C=C3)C5=CC(=CC=C5)Cl)C(=O)C1)C |
Product Overview
BAS 00457518 (CAS 22949-38-8), with molecular formula C25H22ClNO and molecular weight 387.14 g/mol. IUPAC: 5-(3-chlorophenyl)-2,2-dimethyl-1,3,5,6-tetrahydrobenzo[a]phenanthridin-4-one.
Chemical Property Profile of BAS 00457518
Property Insights of BAS 00457518
The XLogP value of 6.8027 indicates that BAS 00457518 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, BAS 00457518 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00457518 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00457518?
The CAS number of BAS 00457518 is 22949-38-8.
What is the molecular formula of BAS 00457518?
The molecular formula of BAS 00457518 is C25H22ClNO.
What is the molecular weight of BAS 00457518?
The molecular weight of BAS 00457518 is 387.14 g/mol.
Where can I buy BAS 00457518?
You can request a quote for BAS 00457518 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00457518?
Yes, KEHONG BIO provides custom synthesis services for BAS 00457518 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.