2-[(ethyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)methyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-[(ethyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)methyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
2-[(ethyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)methyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
Compound ID: | V018-5995 |
Compound Name: | 2-[(ethyl{2-hydroxy-3-[(prop-2-en-1-yl)oxy]propyl}amino)methyl]-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
Molecular Weight: | 363.48 |
Molecular Formula: | C18 H25 N3 O3 S |
Salt: | not_available |
Smiles: | CCN(CC(COCC=C)O)CC1NC(c2c3CCCc3sc2N=1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7779 |
logD: | 1.7767 |
logSw: | -2.3981 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.041 |
InChI Key: | ZBWGZKUNEPWQPQ-LBPRGKRZSA-N |