Deoxy Blebbistatin
TL;DR: Deoxy Blebbistatin (CAS 856925-72-9) is a chemical compound with molecular formula C18H16N2O and molecular weight 276.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-1-phenyl-3,3a-dihydro-2H-pyrrolo[2,3-b]quinolin-4-one
Also Known As: Deoxy Blebbistatin, DEOXYBLEBBISTATIN, 6-methyl-1-phenyl-3,3a-dihydro-2H-pyrrolo[2,3-b]quinolin-4-one, 6-methyl-1-phenyl-1,2,3,3a-tetrahydro-4H-pyrrolo[2,3-b]quinolin-4-one, 1,2,3,9-Tetrahydro-6-methyl-1-phenyl-4H-pyrrolo[2,3-b]quinolin-4-one
| Molecular Formula | C18H16N2O |
|---|---|
| Molecular Weight | 276.13 g/mol |
| LogP | 3.74782 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 276.12625 |
| Heavy Atoms | 21 |
| Complexity | 749.06854 |
Chemical Identifiers
| CAS Number | 856925-72-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C3C(C2=O)CCN3C4=CC=CC=C4 |
Product Overview
Deoxy Blebbistatin (CAS 856925-72-9), with molecular formula C18H16N2O and molecular weight 276.13 g/mol. IUPAC: 6-methyl-1-phenyl-3,3a-dihydro-2H-pyrrolo[2,3-b]quinolin-4-one.
Chemical Property Profile of Deoxy Blebbistatin
Property Insights of Deoxy Blebbistatin
The XLogP value of 3.74782 indicates that Deoxy Blebbistatin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, Deoxy Blebbistatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Deoxy Blebbistatin has 0 hydrogen bond donor(s) and 3 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 Deoxy Blebbistatin?
The CAS number of Deoxy Blebbistatin is 856925-72-9.
What is the molecular formula of Deoxy Blebbistatin?
The molecular formula of Deoxy Blebbistatin is C18H16N2O.
What is the molecular weight of Deoxy Blebbistatin?
The molecular weight of Deoxy Blebbistatin is 276.13 g/mol.
Where can I buy Deoxy Blebbistatin?
You can request a quote for Deoxy Blebbistatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deoxy Blebbistatin?
Yes, KEHONG BIO provides custom synthesis services for Deoxy Blebbistatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.