EINECS 277-417-1
TL;DR: EINECS 277-417-1 (CAS 73384-74-4) is a chemical compound with molecular formula C20H21N5O2S and molecular weight 395.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[N-(2-hydroxyethyl)-4-[(6-methoxy-1,3-benzothiazol-2-yl)diazenyl]-3-methylanilino]propanenitrile
Also Known As: EINECS 277-417-1, 3-((2-Hydroxyethyl)(4-((6-methoxybenzothiazol-2-yl)azo)-3-methylphenyl)amino)propiononitrile, 3-[(2-HYDROXYETHYL)[4-[(6-METHOXYBENZOTHIAZOL-2-YL)AZO]-3-METHYLPHENYL]AMINO]PROPIONONITRILE, 3-[(2-Hydroxyethyl)[4-[2-(6-methoxy-2-benzothiazolyl)diazenyl]-3-methylphenyl]amino]propanenitrile, 3-[N-(2-hydroxyethyl)-4-[(6-methoxy-1,3-benzothiazol-2-yl)diazenyl]-3-methylanilino]propanenitrile
| Molecular Formula | C20H21N5O2S |
|---|---|
| Molecular Weight | 395.14 g/mol |
| LogP | 4.7411 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 395.1416 |
| Heavy Atoms | 28 |
| Complexity | 1025.0983 |
Chemical Identifiers
| CAS Number | 73384-74-4 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N(CCC#N)CCO)N=NC2=NC3=C(S2)C=C(C=C3)OC |
Product Overview
EINECS 277-417-1 (CAS 73384-74-4), with molecular formula C20H21N5O2S and molecular weight 395.14 g/mol. IUPAC: 3-[N-(2-hydroxyethyl)-4-[(6-methoxy-1,3-benzothiazol-2-yl)diazenyl]-3-methylanilino]propanenitrile.
Chemical Property Profile of EINECS 277-417-1
Property Insights of EINECS 277-417-1
The XLogP value of 4.7411 indicates that EINECS 277-417-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 277-417-1. Following Lipinski's Rule of Five, EINECS 277-417-1 has 1 hydrogen bond donor(s) and 8 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 EINECS 277-417-1?
The CAS number of EINECS 277-417-1 is 73384-74-4.
What is the molecular formula of EINECS 277-417-1?
The molecular formula of EINECS 277-417-1 is C20H21N5O2S.
What is the molecular weight of EINECS 277-417-1?
The molecular weight of EINECS 277-417-1 is 395.14 g/mol.
Where can I buy EINECS 277-417-1?
You can request a quote for EINECS 277-417-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 277-417-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 277-417-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.