N-(10-cyclopentyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-(10-cyclopentyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-nitrofuran-2-carboxamide
N-(10-cyclopentyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-nitrofuran-2-carboxamide
Compound characteristics
| Compound ID: | G943-0691 |
| Compound Name: | N-(10-cyclopentyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-5-nitrofuran-2-carboxamide |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C23 H19 N3 O5 S |
| Smiles: | C1CCC(C1)N1C(c2ccccc2Sc2cc(ccc12)NC(c1ccc([N+]([O-])=O)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7865 |
| logD: | 4.7864 |
| logSw: | -4.8406 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.74 |
| InChI Key: | FUBURVOUVUBGCT-UHFFFAOYSA-N |