6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one
TL;DR: 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one (CAS 896063-48-2) is a chemical compound with molecular formula C17H18N2O4 and molecular weight 314.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-1,3-dioxin-4-one
Also Known As: 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one, 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-1,3-dioxin-4-one, 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-4H-1,3-dioxin-4-one
| Molecular Formula | C17H18N2O4 |
|---|---|
| Molecular Weight | 314.13 g/mol |
| LogP | 2.4338 |
| Topological Polar Surface Area | 83.58 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 314.12665 |
| Heavy Atoms | 23 |
| Complexity | 834.231 |
Chemical Identifiers
| CAS Number | 896063-48-2 |
|---|---|
| SMILES | CC1(OC(=C(C(=O)O1)C2C3=C(CCN2)C4=CC=CC=C4N3)O)C |
Product Overview
6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one (CAS 896063-48-2), with molecular formula C17H18N2O4 and molecular weight 314.13 g/mol. IUPAC: 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-1,3-dioxin-4-one.
Chemical Property Profile of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one
Property Insights of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one
The XLogP value of 2.4338 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one. The TPSA of 83.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one. Following Lipinski's Rule of Five, 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one has 3 hydrogen bond donor(s) and 5 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-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one?
The CAS number of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one is 896063-48-2.
What is the molecular formula of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one?
The molecular formula of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one is C17H18N2O4.
What is the molecular weight of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one?
The molecular weight of 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one is 314.13 g/mol.
Where can I buy 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one?
You can request a quote for 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-hydroxy-2,2-dimethyl-5-(2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)-4H-1,3-dioxin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.