5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile
TL;DR: 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile (CAS 134312-09-7) is a chemical compound with molecular formula C10H7N5O2S and molecular weight 261.03204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile
Also Known As: 5-amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile, NCI60_012712, 5-amino-2-[(4-nitrophenyl)amino]-1,3-thiazole-4-carbonitrile, 8F-900, 5-amino-2-(4-nitroanilino)thiazole-4-carbonitrile
Technical Specifications
| Molecular Formula | C10H7N5O2S |
| Molecular Weight | 261.03204 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 149.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.03204 Da |
| Heavy Atoms | 18 |
| Complexity | 357.0 |
| SMILES | C1=CC(=CC=C1NC2=NC(=C(S2)N)C#N)[N+](=O)[O-] |
| InChIKey | WKZFHIVAXRJZRH-UHFFFAOYSA-N |
Chemical Property Profile of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile
Property Insights of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile. The TPSA of 149.0 Ų indicates high polarity, suggesting 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile?
The CAS number of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile is 134312-09-7.
What is the molecular formula of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile?
The molecular formula of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile is C10H7N5O2S.
What is the molecular weight of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile?
The molecular weight of 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile is 261.03204 g/mol.
Where can I buy 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile?
You can request a quote for 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 5-Amino-2-(4-nitroanilino)-1,3-thiazole-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.