N-(2-chloroethyl)-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Chemical Structure Depiction of
N-(2-chloroethyl)-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
N-(2-chloroethyl)-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Compound characteristics
| Compound ID: | 8014-1995 |
| Compound Name: | N-(2-chloroethyl)-1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide |
| Molecular Weight: | 358.74 |
| Molecular Formula: | C17 H11 Cl N2 O5 |
| Smiles: | C(C[Cl])NC(c1ccc2C(c3ccccc3C(c2c1[N+]([O-])=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7197 |
| logD: | 3.705 |
| logSw: | -4.5217 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.486 |
| InChI Key: | LDGBNQLPQDXJDU-UHFFFAOYSA-N |