E-2011
TL;DR: E-2011 (CAS 150366-18-0) is a chemical compound with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanenitrile
Also Known As: E-2011, 3[2-(1(S)-Hydroxy-3-cyanopropyl)benzothiazol-6-yl]-5(R)-methoxymethyl-2-oxazolidinone, 3-[2-(1(S)-Hydroxy-3-cyanopropyl)benzothiazol-6-yl]-5(R)-methoxymethyl-2-oxazolidinone, (4S)-4-[6-[(5R)-5-Methoxymethyl-2-oxooxazolidin-3-yl]benzothiazol-2-yl]-4-hydroxybutanenitrile, (4S)-4-hydroxy-4-{6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl}butanenitrile
| Molecular Formula | C16H17N3O4S |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 2.60508 |
| Topological Polar Surface Area | 95.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.09396 |
| Heavy Atoms | 24 |
| Complexity | 785.21075 |
Chemical Identifiers
| CAS Number | 150366-18-0 |
|---|---|
| SMILES | COC[C@H]1CN(C(=O)O1)C2=CC3=C(C=C2)N=C(S3)[C@H](CCC#N)O |
Product Overview
E-2011 (CAS 150366-18-0), with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol. IUPAC: (4S)-4-hydroxy-4-[6-[(5R)-5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]-1,3-benzothiazol-2-yl]butanenitrile.
Chemical Property Profile of E-2011
Property Insights of E-2011
The XLogP value of 2.60508 suggests moderate lipophilicity, balancing water solubility and membrane permeability for E-2011. The TPSA of 95.68 Ų falls within the moderate polarity range, balancing permeability and solubility for E-2011. Following Lipinski's Rule of Five, E-2011 has 1 hydrogen bond donor(s) and 7 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 E-2011?
The CAS number of E-2011 is 150366-18-0.
What is the molecular formula of E-2011?
The molecular formula of E-2011 is C16H17N3O4S.
What is the molecular weight of E-2011?
The molecular weight of E-2011 is 347.09 g/mol.
Where can I buy E-2011?
You can request a quote for E-2011 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for E-2011?
Yes, KEHONG BIO provides custom synthesis services for E-2011 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.