BAS 02053665
TL;DR: BAS 02053665 (CAS 438606-16-7) is a chemical compound with molecular formula C27H19ClN2O2S and molecular weight 470.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile
Also Known As: BAS 02053665, 4-(4-chlorophenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile, 4-(4-chlorophenyl)-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-6-phenylnicotinonitrile, 4-(4-CHLOROPHENYL)-2-{[2-(4-METHOXYPHENYL)-2-OXOETHYL]SULFANYL}-6-PHENYL-3-PYRIDYL CYANIDE, 4-(4-chlorophenyl)-2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
| Molecular Formula | C27H19ClN2O2S |
|---|---|
| Molecular Weight | 470.09 g/mol |
| LogP | 6.92428 |
| Topological Polar Surface Area | 62.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 470.08557 |
| Heavy Atoms | 33 |
| Complexity | 1315.5802 |
Chemical Identifiers
| CAS Number | 438606-16-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C#N |
Product Overview
BAS 02053665 (CAS 438606-16-7), with molecular formula C27H19ClN2O2S and molecular weight 470.09 g/mol. IUPAC: 4-(4-chlorophenyl)-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-6-phenylpyridine-3-carbonitrile.
Chemical Property Profile of BAS 02053665
Property Insights of BAS 02053665
The XLogP value of 6.92428 indicates that BAS 02053665 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02053665. Following Lipinski's Rule of Five, BAS 02053665 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02053665?
The CAS number of BAS 02053665 is 438606-16-7.
What is the molecular formula of BAS 02053665?
The molecular formula of BAS 02053665 is C27H19ClN2O2S.
What is the molecular weight of BAS 02053665?
The molecular weight of BAS 02053665 is 470.09 g/mol.
Where can I buy BAS 02053665?
You can request a quote for BAS 02053665 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02053665?
Yes, KEHONG BIO provides custom synthesis services for BAS 02053665 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.