BAS 00818565
TL;DR: BAS 00818565 (CAS 332024-65-4) is a chemical compound with molecular formula C32H35ClN2O2S and molecular weight 546.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(cyclohexylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: BAS 00818565, 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(cyclohexylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one, 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(cyclohexylmethyl)-5,6-dihydrospiro(benzo[h]quinazoline-5,1'-cyclohexane)-4(3H)-one, 2-((2-(4-chlorophenyl)-2-oxoethyl)thio)-3-(cyclohexylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one, 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(cyclohexylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
| Molecular Formula | C32H35ClN2O2S |
|---|---|
| Molecular Weight | 546.21 g/mol |
| LogP | 7.877 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 546.21075 |
| Heavy Atoms | 38 |
| Complexity | 1385.5587 |
Chemical Identifiers
| CAS Number | 332024-65-4 |
|---|---|
| SMILES | C1CCC(CC1)CN2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)C6=CC=C(C=C6)Cl |
Product Overview
BAS 00818565 (CAS 332024-65-4), with molecular formula C32H35ClN2O2S and molecular weight 546.21 g/mol. IUPAC: 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-(cyclohexylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
Chemical Property Profile of BAS 00818565
Property Insights of BAS 00818565
The XLogP value of 7.877 indicates that BAS 00818565 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, BAS 00818565 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00818565 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00818565?
The CAS number of BAS 00818565 is 332024-65-4.
What is the molecular formula of BAS 00818565?
The molecular formula of BAS 00818565 is C32H35ClN2O2S.
What is the molecular weight of BAS 00818565?
The molecular weight of BAS 00818565 is 546.21 g/mol.
Where can I buy BAS 00818565?
You can request a quote for BAS 00818565 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00818565?
Yes, KEHONG BIO provides custom synthesis services for BAS 00818565 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.