(2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide
TL;DR: (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide (CAS 361375-09-9) is a chemical compound with molecular formula C16H10N2O3S and molecular weight 310.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)acetamide
Also Known As: IDI1_023099, BRD-K05722542-001-01-2, (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)acetamide, (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide, (Z)-2-cyano-2-(5-hydroxy-7-phenylbenzo[d][1,3]oxathiol-2-ylidene)acetamide
| Molecular Formula | C16H10N2O3S |
|---|---|
| Molecular Weight | 310.04 g/mol |
| LogP | 2.76418 |
| Topological Polar Surface Area | 96.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.0412 |
| Heavy Atoms | 22 |
| Complexity | 838.4597 |
Chemical Identifiers
| CAS Number | 361375-09-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C3C(=CC(=C2)O)S/C(=C(/C#N)\C(=O)N)/O3 |
Product Overview
(2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide (CAS 361375-09-9), with molecular formula C16H10N2O3S and molecular weight 310.04 g/mol. IUPAC: (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)acetamide.
Chemical Property Profile of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide
Property Insights of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide
The XLogP value of 2.76418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide. The TPSA of 96.34 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide. Following Lipinski's Rule of Five, (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide has 2 hydrogen bond donor(s) and 5 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 (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide?
The CAS number of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide is 361375-09-9.
What is the molecular formula of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide?
The molecular formula of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide is C16H10N2O3S.
What is the molecular weight of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide?
The molecular weight of (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide is 310.04 g/mol.
Where can I buy (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide?
You can request a quote for (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-cyano-2-(5-hydroxy-7-phenyl-1,3-benzoxathiol-2-ylidene)ethanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.