AC1MXJ3Z
1-amino-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile
Also Known As: ChemDiv1_020864|HMS646E08|SR-01000423514-1|1-amino-3-[4-(propan-2-yl)phenyl]-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile|1-amino-3-(4-isopropylphenyl)-3H-benzo[4,5]thiazolo[3,2-a]pyridine-2,4-dicarbonitrile|1-amino-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile|4-Amino-2-(4-isopropyl-phenyl)-2H-9-thia-4a-aza-fluorene-1,3-dicarbonitrile
| Molecular Formula | C22H18N4S |
|---|---|
| Molecular Weight | 370.1252 g/mol |
| LogP | 4.94856 |
| Topological Polar Surface Area | 76.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.1252 |
| Monoisotopic Mass | 370.1252 |
| Heavy Atoms | 27 |
| Complexity | 1064.727 |
Chemical Identifiers
| CAS Number | 330158-91-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C(=C(N3C4=CC=CC=C4SC3=C2C#N)N)C#N |
Product Overview
AC1MXJ3Z (CAS 330158-91-3), with molecular formula C22H18N4S and molecular weight 370.1252 g/mol. IUPAC: 1-amino-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile.
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