4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one
TL;DR: 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one (CAS 72036-46-5) is a chemical compound with molecular formula C18H16N2O and molecular weight 276.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10,11-dimethyl-5-(methylamino)-11-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2(7),3,5,9,12,14-heptaen-8-one
Also Known As: 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one, 4,5-Dimethyl-8-(methylamino)naphtho[3,2,1-cd]indol-6(4H)-one, 10,11-Dimethyl-5-(methylamino)-11-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2(7),3,5,9,12,14-heptaen-8-one
| Molecular Formula | C18H16N2O |
|---|---|
| Molecular Weight | 276.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 276.12625 |
| Heavy Atoms | 21 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 72036-46-5 |
|---|---|
| SMILES | CC1=C2C3=C(C=CC=C3N1C)C4=C(C2=O)C=C(C=C4)NC |
| InChIKey | MRWXJRZJVQUMOO-UHFFFAOYSA-N |
Product Overview
4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one (CAS 72036-46-5), with molecular formula C18H16N2O and molecular weight 276.13 g/mol. IUPAC: 10,11-dimethyl-5-(methylamino)-11-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2(7),3,5,9,12,14-heptaen-8-one.
Chemical Property Profile of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one
Property Insights of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one
The XLogP value of 3.5 indicates that 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.0 Ų, 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one has 1 hydrogen bond donor(s) and 2 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 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one?
The CAS number of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one is 72036-46-5.
What is the molecular formula of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one?
The molecular formula of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one is C18H16N2O.
What is the molecular weight of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one?
The molecular weight of 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one is 276.13 g/mol.
Where can I buy 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one?
You can request a quote for 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-8-(methylamino)naphthindol-6-(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.