![6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one structure](/static/products/3464/3464-82-2.webp)
6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one
TL;DR: 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one (CAS 3464-82-2) is a chemical compound with molecular formula C12H12N2O and molecular weight 200.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
Also Known As: ZERO/005501, 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one, 6-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one, 6-methyl-2,3,4-trihydrobeta-carbolin-1-one, 6-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one
| Molecular Formula | C12H12N2O |
|---|---|
| Molecular Weight | 200.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 44.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.09496 |
| Heavy Atoms | 15 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 3464-82-2 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCNC3=O |
| InChIKey | XVVJFCFUHVBAEC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one (CAS 3464-82-2), with molecular formula C12H12N2O and molecular weight 200.09 g/mol. IUPAC: 6-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one.
Chemical Property Profile of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one
Property Insights of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one. With a topological polar surface area (TPSA) of 44.9 Ų, 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one has 2 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 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one?
The CAS number of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one is 3464-82-2.
What is the molecular formula of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one?
The molecular formula of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one is C12H12N2O.
What is the molecular weight of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one?
The molecular weight of 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one is 200.09 g/mol.
Where can I buy 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one?
You can request a quote for 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 6-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.