CBMicro_028123
2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: CBMicro_028123|butyl-Carbonimidicdichloride|malonaldehyde bis-phenylimine|Oprea1_814879|BIM-0027859.P001|AG-690/11662052|2-Amino-4(4-bromo-5-ethylthiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile|2-amino-4-(4-bromo-5-ethyl(2-thienyl))-5,6,7,8-tetrahydroquinoline-3-carbonitr ile|2-Amino-4-(4-bromo-5-ethyl-2-thienyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile|2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile|2-Amino-4-(4-bromo-5-ethyl-2-thienyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile #|4-(4-Bromo-5-ethylthiophen-2-yl)-2-imino-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
| Molecular Formula | C16H16BrN3S |
|---|---|
| Molecular Weight | 361.02484 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 361.02484 |
| Monoisotopic Mass | 361.02484 |
| Heavy Atoms | 21 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 5652-92-6 |
|---|---|
| SMILES | CCC1=C(C=C(S1)C2=C(C(=NC3=C2CCCC3)N)C#N)Br |
| InChIKey | MUVCSHFQNMCYMI-UHFFFAOYSA-N |
Product Overview
CBMicro_028123 (CAS 5652-92-6), with molecular formula C16H16BrN3S and molecular weight 361.02484 g/mol. IUPAC: 2-amino-4-(4-bromo-5-ethylthiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile.
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