Fluorene-9,9-dimethanol
TL;DR: Fluorene-9,9-dimethanol (CAS 442556-28-7) is a chemical compound with molecular formula C18H14BrN3O2S and molecular weight 415.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-(4-bromophenyl)-5-oxo-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide
Also Known As: Fluorene-9,9-dimethanol, 3-amino-N-(4-bromophenyl)-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide, AB00673290-01, F1109-0059, 3-amino-N-(4-bromophenyl)-5-oxo-5H,6H,7H,8H-thieno[2,3-b]quinoline-2-carboxamide
| Molecular Formula | C18H14BrN3O2S |
|---|---|
| Molecular Weight | 415.00 g/mol |
| LogP | 4.4123 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.99902 |
| Heavy Atoms | 25 |
| Complexity | 1011.32825 |
Chemical Identifiers
| CAS Number | 442556-28-7 |
|---|---|
| SMILES | C1CC2=C(C=C3C(=C(SC3=N2)C(=O)NC4=CC=C(C=C4)Br)N)C(=O)C1 |
Product Overview
Fluorene-9,9-dimethanol (CAS 442556-28-7), with molecular formula C18H14BrN3O2S and molecular weight 415.00 g/mol. IUPAC: 3-amino-N-(4-bromophenyl)-5-oxo-7,8-dihydro-6H-thieno[2,3-b]quinoline-2-carboxamide.
Chemical Property Profile of Fluorene-9,9-dimethanol
Property Insights of Fluorene-9,9-dimethanol
The XLogP value of 4.4123 indicates that Fluorene-9,9-dimethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluorene-9,9-dimethanol. Following Lipinski's Rule of Five, Fluorene-9,9-dimethanol has 2 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 Fluorene-9,9-dimethanol?
The CAS number of Fluorene-9,9-dimethanol is 442556-28-7.
What is the molecular formula of Fluorene-9,9-dimethanol?
The molecular formula of Fluorene-9,9-dimethanol is C18H14BrN3O2S.
What is the molecular weight of Fluorene-9,9-dimethanol?
The molecular weight of Fluorene-9,9-dimethanol is 415.00 g/mol.
Where can I buy Fluorene-9,9-dimethanol?
You can request a quote for Fluorene-9,9-dimethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluorene-9,9-dimethanol?
Yes, KEHONG BIO provides custom synthesis services for Fluorene-9,9-dimethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.