4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-
TL;DR: 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- (CAS 135521-74-3) is a chemical compound with molecular formula C19H13ClN2OS and molecular weight 352.0437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-9-chloro-4-phenyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile
Also Known As: 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-, 2-Amino-9-chloro-4-phenyl-4H,5H-(1)benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-4,5-dihydrothiochromeno[4,3-b]pyran-3-carbonitrile, 2-Amino-9-chloro-4-phenyl-4H,5H-[1]benzothiopyrano[4,3-b]pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-4H,5H-thiochromeno[4,3-b]pyran-3-carbonitrile
Technical Specifications
| Molecular Formula | C19H13ClN2OS |
| Molecular Weight | 352.0437 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 84.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 352.0437 Da |
| Heavy Atoms | 24 |
| Complexity | 629.0 |
| SMILES | C1C2=C(C3=C(S1)C=CC(=C3)Cl)OC(=C(C2C4=CC=CC=C4)C#N)N |
| InChIKey | DRFXEYGEYDNGTL-UHFFFAOYSA-N |
Chemical Property Profile of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-
Property Insights of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-
The XLogP value of 4.1 indicates that 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-. Following Lipinski's Rule of Five, 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-?
The CAS number of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- is 135521-74-3.
What is the molecular formula of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-?
The molecular formula of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- is C19H13ClN2OS.
What is the molecular weight of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-?
The molecular weight of 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- is 352.0437 g/mol.
Where can I buy 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-?
You can request a quote for 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl-?
Yes, CoreyChem provides custom synthesis services for 4H,5H-(1)Benzothiopyrano(4,3-b)pyran-3-carbonitrile, 2-amino-9-chloro-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.