BRD-K35852464-001-01-5
TL;DR: BRD-K35852464-001-01-5 (CAS 896357-51-0) is a chemical compound with molecular formula C20H20N2O5S and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide
Also Known As: BRD-K35852464-001-01-5, F2669-0072, N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-oxo-1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-triene-7-sulfonamide, N-(1,3-benzodioxol-5-ylmethyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide, N-(1,3-benzodioxol-5-ylmethyl)-3-oxo-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline-9-sulfonamide
| Molecular Formula | C20H20N2O5S |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 2.1192 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.10928 |
| Heavy Atoms | 28 |
| Complexity | 1062.9939 |
Chemical Identifiers
| CAS Number | 896357-51-0 |
|---|---|
| SMILES | C1CC2=C3C(=CC(=C2)S(=O)(=O)NCC4=CC5=C(C=C4)OCO5)CCC(=O)N3C1 |
Product Overview
BRD-K35852464-001-01-5 (CAS 896357-51-0), with molecular formula C20H20N2O5S and molecular weight 400.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide.
Chemical Property Profile of BRD-K35852464-001-01-5
Property Insights of BRD-K35852464-001-01-5
The XLogP value of 2.1192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRD-K35852464-001-01-5. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K35852464-001-01-5. Following Lipinski's Rule of Five, BRD-K35852464-001-01-5 has 1 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 BRD-K35852464-001-01-5?
The CAS number of BRD-K35852464-001-01-5 is 896357-51-0.
What is the molecular formula of BRD-K35852464-001-01-5?
The molecular formula of BRD-K35852464-001-01-5 is C20H20N2O5S.
What is the molecular weight of BRD-K35852464-001-01-5?
The molecular weight of BRD-K35852464-001-01-5 is 400.11 g/mol.
Where can I buy BRD-K35852464-001-01-5?
You can request a quote for BRD-K35852464-001-01-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K35852464-001-01-5?
Yes, KEHONG BIO provides custom synthesis services for BRD-K35852464-001-01-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.