Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one
TL;DR: Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one (CAS 77976-31-9) is a chemical compound with molecular formula C19H11NO2 and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
20-oxa-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18-nonaen-21-one
Also Known As: Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one, Benzo[e][1]benzopyrano[4,3-b]indol-6(13H)-one, BENZO[E](1)BENZOPYRANO[4,3-B]INDOL-6(13H)-ONE, N-BENZYL-6,6-DIMETHYL-4-MORPHOLIN-4-YL-5H-PYRIDIN-2-AMINE
| Molecular Formula | C19H11NO2 |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 285.07898 |
| Heavy Atoms | 22 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 77976-31-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=C2C4=C(N3)C5=CC=CC=C5OC4=O |
| InChIKey | BCIKMYGJYYVSJO-UHFFFAOYSA-N |
Product Overview
Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one (CAS 77976-31-9), with molecular formula C19H11NO2 and molecular weight 285.08 g/mol. IUPAC: 20-oxa-12-azapentacyclo[11.8.0.02,11.03,8.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18-nonaen-21-one.
Chemical Property Profile of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one
Property Insights of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one
The XLogP value of 4.4 indicates that Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.1 Ų, Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-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 Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one?
The CAS number of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one is 77976-31-9.
What is the molecular formula of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one?
The molecular formula of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one is C19H11NO2.
What is the molecular weight of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one?
The molecular weight of Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one is 285.08 g/mol.
Where can I buy Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one?
You can request a quote for Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one?
Yes, KEHONG BIO provides custom synthesis services for Benzo(e)(1)benzopyrano(4,3-b)indol-6(13H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.