Chemical ID: 4380727

c1cc(sc1)CN2CCC(CC2)C(=O)N3CCN(CC3)Cc4ccc5c(c4)OCO5
Chemical ID:
4380727
Name [?]:
[4-(benzo[1,3]dioxol-5-ylmethyl)piperazin-1-yl]-[1-(2-thienylmethyl)-4-piperidyl]-methanone
SMILES [?]:
c1cc(sc1)CN2CCC(CC2)C(=O)N3CCN(CC3)Cc4ccc5c(c4)OCO5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H29N3O3S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.0773
Area:654.874
Solvation:-5.29453
Coulombic:-42.3337
Bond Count [?]
All:34
Single:28
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:427.561
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:1.79
LogP (Chemaxon):2.29

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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