N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide

Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide
Available: 51 mg
Amount:
mg
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Compound characteristics

Compound ID: C241-1403
Compound Name: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-[1-(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl]butanamide
Molecular Weight: 552.65
Molecular Formula: C28 H32 N4 O6 S
Smiles: C1CCC(CCNC(CN2C(N(CCCC(NCc3ccc4c(c3)OCO4)=O)C(c3c2ccs3)=O)=O)=O)=CC1
Stereo: ACHIRAL
logP: 2.599
logD: 2.599
logSw: -3.1104
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 98.356
InChI Key: HGXAQYNTNZRZMG-UHFFFAOYSA-N
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