3-amino-N-(3-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide

Base Information

• Chemical Name: 3-amino-N-(3-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide
• CAS No.: 6418-29-7
• Molecular Formula: C21H23N3OS
• Molecular Weight: 365.5
• DSSTox Substance ID: DTXSID20359860
• Wikidata: Q82141270
• Mol file: 6418-29-7.mol

Synonyms:3-amino-N-(3-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide;6418-29-7;6-amino-N-(3-methylphenyl)-4-thia-2-azatricyclo[7.6.0.03,7]pentadeca-1,3(7),5,8-tetraene-5-carboxamide;Oprea1_521347;DTXSID20359860;STK680804;AKOS005596148

Chemical Property of 3-amino-N-(3-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide

Chemical Property:

• Vapor Pressure: 4.53E-11mmHg at 25°C
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 365.15618354
• Heavy Atom Count: 26
• Complexity: 502

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)NC(=O)C2=C(C3=C(S2)N=C4CCCCCCC4=C3)N