BAS 00615638
TL;DR: BAS 00615638 (CAS 833488-24-7) is a chemical compound with molecular formula C21H18F2N2S and molecular weight 368.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8E)-4-(4-fluorophenyl)-8-[(4-fluorophenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione
Also Known As: BAS 00615638, AE-848/32006058, (8E)-8-(4-fluorobenzylidene)-4-(4-fluorophenyl)-3,4,5,6,7,8-hexahydroquinazoline-2(1H)-thione, 8-(4-fluorobenzylidene)-4-(4-fluorophenyl)-3,4,5,6,7,8-hexahydro-2(1H)-quinazolinethione, (8E)-4-(4-FLUOROPHENYL)-8-[(4-FLUOROPHENYL)METHYLIDENE]-1,2,3,4,5,6,7,8-OCTAHYDROQUINAZOLINE-2-THIONE
| Molecular Formula | C21H18F2N2S |
|---|---|
| Molecular Weight | 368.12 g/mol |
| LogP | 5.0052 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.11588 |
| Heavy Atoms | 26 |
| Complexity | 898.6132 |
Chemical Identifiers
| CAS Number | 833488-24-7 |
|---|---|
| SMILES | C1C/C(=C\C2=CC=C(C=C2)F)/C3=C(C1)C(NC(=S)N3)C4=CC=C(C=C4)F |
Product Overview
BAS 00615638 (CAS 833488-24-7), with molecular formula C21H18F2N2S and molecular weight 368.12 g/mol. IUPAC: (8E)-4-(4-fluorophenyl)-8-[(4-fluorophenyl)methylidene]-1,3,4,5,6,7-hexahydroquinazoline-2-thione.
Chemical Property Profile of BAS 00615638
Property Insights of BAS 00615638
The XLogP value of 5.0052 indicates that BAS 00615638 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, BAS 00615638 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00615638 has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00615638?
The CAS number of BAS 00615638 is 833488-24-7.
What is the molecular formula of BAS 00615638?
The molecular formula of BAS 00615638 is C21H18F2N2S.
What is the molecular weight of BAS 00615638?
The molecular weight of BAS 00615638 is 368.12 g/mol.
Where can I buy BAS 00615638?
You can request a quote for BAS 00615638 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00615638?
Yes, KEHONG BIO provides custom synthesis services for BAS 00615638 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.