BAS 01337700
TL;DR: BAS 01337700 (CAS 337499-16-8) is a chemical compound with molecular formula C34H25N3O3S2 and molecular weight 587.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-6-phenylpyridine-3-carbonitrile
Also Known As: BAS 01337700, 4-(3,4-Dimethoxyphenyl)-2-((2-oxo-2-(10H-phenothiazin-10-yl)ethyl)thio)-6-phenylnicotinonitrile, 4-(3,4-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-6-phenylpyridine-3-carbonitrile, 4-(3,4-Dimethoxy-phenyl)-2-(2-oxo-2-phenothiazin-10-yl-ethylsulfanyl)-6-phenyl-nicotinonitrile, 4-(3,4-dimethoxyphenyl)-2-{[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]sulfanyl}-6-phenylnicotinonitrile
| Molecular Formula | C34H25N3O3S2 |
|---|---|
| Molecular Weight | 587.13 g/mol |
| LogP | 8.22608 |
| Topological Polar Surface Area | 75.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 587.1337 |
| Heavy Atoms | 42 |
| Complexity | 1791.1057 |
Chemical Identifiers
| CAS Number | 337499-16-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6)OC |
Product Overview
BAS 01337700 (CAS 337499-16-8), with molecular formula C34H25N3O3S2 and molecular weight 587.13 g/mol. IUPAC: 4-(3,4-dimethoxyphenyl)-2-(2-oxo-2-phenothiazin-10-ylethyl)sulfanyl-6-phenylpyridine-3-carbonitrile.
Chemical Property Profile of BAS 01337700
Property Insights of BAS 01337700
The XLogP value of 8.22608 indicates that BAS 01337700 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01337700. Following Lipinski's Rule of Five, BAS 01337700 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01337700?
The CAS number of BAS 01337700 is 337499-16-8.
What is the molecular formula of BAS 01337700?
The molecular formula of BAS 01337700 is C34H25N3O3S2.
What is the molecular weight of BAS 01337700?
The molecular weight of BAS 01337700 is 587.13 g/mol.
Where can I buy BAS 01337700?
You can request a quote for BAS 01337700 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01337700?
Yes, KEHONG BIO provides custom synthesis services for BAS 01337700 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.