ethyl 4-[5-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanoyl]piperazine-1-carboxylate

Chemical Structure Depiction of
ethyl 4-[5-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanoyl]piperazine-1-carboxylate
Available: 154 mg
Amount:
mg
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Compound characteristics

Compound ID: C675-0138
Compound Name: ethyl 4-[5-(8-methoxy-4-oxo-2-sulfanylidene-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanoyl]piperazine-1-carboxylate
Molecular Weight: 487.58
Molecular Formula: C23 H29 N5 O5 S
Smiles: CCOC(N1CCN(CC1)C(CCCCN1C(c2c(c3cc(ccc3[nH]2)OC)NC1=S)=O)=O)=O
Stereo: ACHIRAL
logP: 1.8617
logD: 1.8616
logSw: -2.6757
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 81.971
InChI Key: AECJWPBDVCAANY-UHFFFAOYSA-N
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