Chemical ID: 6019617

COc1ccc(cc1OC)CCN(Cc2cccs2)C(=O)CNCC3CCCO3
Chemical ID:
6019617
Name [?]:
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(tetrahydrofuran-2-ylmethylamino)-N-(2-thienylmethyl)acetamide
SMILES [?]:
COc1ccc(cc1OC)CCN(Cc2cccs2)C(=O)CNCC3CCCO3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H30N2O4S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:1
ZAP Information [?]
Total:8.3872
Area:683.98
Solvation:-8.71231
Coulombic:-46.5595
Bond Count [?]
All:31
Single:25
Double:6
Rotors:12
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:418.551
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:1.69
LogP (Chemaxon):1.91

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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