5-(ethylamino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Chemical Structure Depiction of
5-(ethylamino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
5-(ethylamino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Compound characteristics
Compound ID: | C620-0361 |
Compound Name: | 5-(ethylamino)-3-(4-methylpiperazin-1-yl)-6H-anthra[1,9-cd][1,2]oxazol-6-one |
Molecular Weight: | 362.43 |
Molecular Formula: | C21 H22 N4 O2 |
Smiles: | CCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)N1CCN(C)CC1 |
Stereo: | ACHIRAL |
logP: | 3.7176 |
logD: | 3.3869 |
logSw: | -4.3674 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.243 |
InChI Key: | XKCVLIQCOHGREZ-UHFFFAOYSA-N |