2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole
TL;DR: 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole (CAS 107369-97-1) is a chemical compound with molecular formula C16H17N3 and molecular weight 251.14224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,6-dimethyl-3,7,17-triazatetracyclo[9.6.0.02,8.012,16]heptadeca-1(11),2(8),3,6,9,12(16)-hexaene
Also Known As: 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole, 3H-Cyclopenta(4,5)pyrrolo(2,3-g)-1,5-benzodiazepine, 8,9,10,11-tetrahydro-2,4-dimethyl-, 8,9,10,11-Tetrahydro-2,4-dimethyl-3H-cyclopenta(4,5)pyrrolo(2,3-g)-1,5-benzodiazepine, 2,4-Dimethyl-8,9,10,11-tetrahydro-3H-cyclopenta[b][1,4]diazepino[2,3-g]indole, BRN 5555611
Technical Specifications
| Molecular Formula | C16H17N3 |
| Molecular Weight | 251.14224 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 251.14224 Da |
| Heavy Atoms | 19 |
| Complexity | 439.0 |
| SMILES | CC1=NC2=C(C3=C(C=C2)C4=C(N3)CCC4)N=C(C1)C |
| InChIKey | YLVCTPIVBLCQFI-UHFFFAOYSA-N |
Chemical Property Profile of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole
Property Insights of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole. With a topological polar surface area (TPSA) of 40.5 Ų, 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole 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
What is the CAS number of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole?
The CAS number of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole is 107369-97-1.
What is the molecular formula of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole?
The molecular formula of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole is C16H17N3.
What is the molecular weight of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole?
The molecular weight of 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole is 251.14224 g/mol.
Where can I buy 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole?
You can request a quote for 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole?
Yes, CoreyChem provides custom synthesis services for 2,4-Dimethyl-8,9-cyclopentene-3H-(1,4)diazepine(2,3-g)indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.