3,8-Dibromo-1-chlorophenanthridin-6(5h)-one
TL;DR: 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one (CAS 27518-97-4) is a chemical compound with molecular formula C13H6Br2ClNO and molecular weight 384.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8-dibromo-1-chloro-5H-phenanthridin-6-one
Also Known As: 3,8-dibromo-1-chlorophenanthridin-6(5h)-one, 3,8-dibromo-1-chloro-5H-phenanthridin-6-one, 6(5H)-Phenanthridinone,3,8-dibromo-1-chloro-
| Molecular Formula | C13H6Br2ClNO |
|---|---|
| Molecular Weight | 384.85 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 384.85046 |
| Heavy Atoms | 18 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 27518-97-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1Br)C(=O)NC3=C2C(=CC(=C3)Br)Cl |
| InChIKey | WSIKQNSRQMINHF-UHFFFAOYSA-N |
Product Overview
3,8-Dibromo-1-chlorophenanthridin-6(5h)-one (CAS 27518-97-4), with molecular formula C13H6Br2ClNO and molecular weight 384.85 g/mol. IUPAC: 3,8-dibromo-1-chloro-5H-phenanthridin-6-one.
Chemical Property Profile of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one
Property Insights of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one
The XLogP value of 4.5 indicates that 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one?
The CAS number of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one is 27518-97-4.
What is the molecular formula of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one?
The molecular formula of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one is C13H6Br2ClNO.
What is the molecular weight of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one?
The molecular weight of 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one is 384.85 g/mol.
Where can I buy 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one?
You can request a quote for 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one?
Yes, KEHONG BIO provides custom synthesis services for 3,8-Dibromo-1-chlorophenanthridin-6(5h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.