AC1NB1RI
N-[3-(4-chlorophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]propanamide
Also Known As: N-[(2Z)-3-(4-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]propanamide|(Z)-N-(3-(4-chlorophenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)propionamide|4-(4-chlorophenyl)-5-(2-oxo-1-azabutylidene)-1,3,4,6,3a,6a-hexahydro-2,6-dithi a-4-azapentalene-2,2-dione|N-[3-(4-chlorophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]propanamide
| Molecular Formula | C14H15ClN2O3S2 |
|---|---|
| Molecular Weight | 358.02127 g/mol |
| LogP | 2.3514 |
| Topological Polar Surface Area | 66.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.02127 |
| Monoisotopic Mass | 358.02127 |
| Heavy Atoms | 22 |
| Complexity | 730.9598 |
Chemical Identifiers
| CAS Number | 877808-87-2 |
|---|---|
| SMILES | CCC(=O)N=C1N(C2CS(=O)(=O)CC2S1)C3=CC=C(C=C3)Cl |
Product Overview
AC1NB1RI (CAS 877808-87-2), with molecular formula C14H15ClN2O3S2 and molecular weight 358.02127 g/mol. IUPAC: N-[3-(4-chlorophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]propanamide.
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