CBKinase1_004376
6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-N-naphthalen-2-yl-1,3,5-triazine-2,4-diamine
Also Known As: CBKinase1_004376|CBKinase1_016776|BAS 06575940|BRD-K21181701-001-01-8|6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-N-(naphthalen-2-yl)-1,3,5-triazine-2,4-diamine|(4E)-6-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-4-(naphthalen-2-ylimino)-4,5-dihydro-1,3,5-triazin-2-amine|{4-amino-6-[(5-methyl(1,3,4-thiadiazol-2-ylthio))methyl](1,3,5-triazin-2-yl)}- 2-naphthylamine|6-(((5-methyl-1,3,4-thiadiazol-2-yl)thio)methyl)-N2-(naphthalen-2-yl)-1,3,5-triazine-2,4-diamine|6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-N-naphthalen-2-yl-1,3,5-triazine-2,4-diamine|6-{[(5-METHYL-1,3,4-THIADIAZOL-2-YL)SULFANYL]METHYL}-N2-(NAPHTHALEN-2-YL)-1,3,5-TRIAZINE-2,4-DIAMINE
| Molecular Formula | C17H15N7S2 |
|---|---|
| Molecular Weight | 381.08304 g/mol |
| LogP | 3.80282 |
| Topological Polar Surface Area | 102.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.08304 |
| Monoisotopic Mass | 381.08304 |
| Heavy Atoms | 26 |
| Complexity | 1063.8623 |
Chemical Identifiers
| CAS Number | 577787-68-9 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC2=NC(=NC(=N2)NC3=CC4=CC=CC=C4C=C3)N |
Product Overview
CBKinase1_004376 (CAS 577787-68-9), with molecular formula C17H15N7S2 and molecular weight 381.08304 g/mol. IUPAC: 6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-N-naphthalen-2-yl-1,3,5-triazine-2,4-diamine.