![2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile structure](/static/products/1495/149550-36-7.webp)
2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile
TL;DR: 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile (CAS 149550-36-7) is a chemical compound with molecular formula C20H13N3O3 and molecular weight 343.0957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile
Also Known As: 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile, BAS 00655259, 2-Amino-4-(3-nitro-phenyl)-4H-benzo[h]chromene-3-carbonitrile, 2-Amino-4-(3-nitrophenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile, 2-Amino-3-cyano-4-(3-nitrophenyl)-4H-naphtho[1,2-b]pyran
Technical Specifications
| Molecular Formula | C20H13N3O3 |
| Molecular Weight | 343.0957 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.0957 Da |
| Heavy Atoms | 26 |
| Complexity | 646.0 |
| SMILES | C1=CC=C2C(=C1)C=CC3=C2OC(=C(C3C4=CC(=CC=C4)[N+](=O)[O-])C#N)N |
| InChIKey | KLHQWXOILCCTOX-UHFFFAOYSA-N |
Chemical Property Profile of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile
Property Insights of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile
The XLogP value of 4.4 indicates that 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile. Following Lipinski's Rule of Five, 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile?
The CAS number of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile is 149550-36-7.
What is the molecular formula of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile?
The molecular formula of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile is C20H13N3O3.
What is the molecular weight of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile?
The molecular weight of 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile is 343.0957 g/mol.
Where can I buy 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile?
You can request a quote for 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 2-amino-4-(3-nitrophenyl)-4H-benzo[h]chromene-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.