![2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde structure](/static/products/658/658041-56-6.png)
2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde
TL;DR: 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde (CAS 658041-56-6) is a chemical compound with molecular formula C18H15N3O2 and molecular weight 305.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-1-phenyl-5,6-dihydro-3H-[1,4]diazepino[6,5-b]indole-4-carbaldehyde
Also Known As: 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde, 2-oxo-1-phenyl-2,3,5,6-tetrahydro-[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde, 2-oxo-1-phenyl-5,6-dihydro-3H-[1,4]diazepino[6,5-b]indole-4-carbaldehyde
| Molecular Formula | C18H15N3O2 |
|---|---|
| Molecular Weight | 305.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 56.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 305.11642 |
| Heavy Atoms | 23 |
| Complexity | 463.0 |
Chemical Identifiers
| CAS Number | 658041-56-6 |
|---|---|
| SMILES | C1C2=C(C3=CC=CC=C3N2)N(C(=O)CN1C=O)C4=CC=CC=C4 |
| InChIKey | HWSMDJRVANESDR-UHFFFAOYSA-N |
Product Overview
2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde (CAS 658041-56-6), with molecular formula C18H15N3O2 and molecular weight 305.12 g/mol. IUPAC: 2-oxo-1-phenyl-5,6-dihydro-3H-[1,4]diazepino[6,5-b]indole-4-carbaldehyde.
Chemical Property Profile of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde
Property Insights of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde. With a topological polar surface area (TPSA) of 56.4 Ų, 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde 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 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde?
The CAS number of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde is 658041-56-6.
What is the molecular formula of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde?
The molecular formula of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde is C18H15N3O2.
What is the molecular weight of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde?
The molecular weight of 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde is 305.12 g/mol.
Where can I buy 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde?
You can request a quote for 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-1-phenyl-2,3,5,6-tetrahydro[1,4]diazepino[6,5-b]indole-4(1H)-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.