6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one
TL;DR: 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (CAS 3449-48-7) is a chemical compound with molecular formula C13H13NO and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2,3,4,9-tetrahydrocarbazol-1-one
Also Known As: 6-Methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one, 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one, ZERO/005406, 6-Methyl-2,3,4,9-tetrahydro-carbazol-1-one, 6-methyl-3,4-dihydro-2H-carbazol-1(9H)-one
| Molecular Formula | C13H13NO |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.09972 |
| Heavy Atoms | 15 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 3449-48-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC3=C2CCCC3=O |
| InChIKey | ITWUGZSJDMBOPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one (CAS 3449-48-7), with molecular formula C13H13NO and molecular weight 199.10 g/mol. IUPAC: 6-methyl-2,3,4,9-tetrahydrocarbazol-1-one.
Chemical Property Profile of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one
Property Insights of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one. With a topological polar surface area (TPSA) of 32.9 Ų, 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-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 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one?
The CAS number of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one is 3449-48-7.
What is the molecular formula of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one?
The molecular formula of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one is C13H13NO.
What is the molecular weight of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one?
The molecular weight of 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one is 199.10 g/mol.
Where can I buy 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one?
You can request a quote for 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-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-2,3,4,9-tetrahydro-1H-carbazol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.