Chemical ID: 6275460

CCOc1ccc(cc1)C(=O)N=c2n(c3ccc(cc3s2)C)CC#C
Chemical ID:
6275460
Name [?]:
4-ethoxy-N-(6-methyl-3-prop-2-ynyl-benzothiazol-2-ylidene)-benzamide
SMILES [?]:
CCOc1ccc(cc1)C(=O)N=c2n(c3ccc(cc3s2)C)CC#C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18N2O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.4949
Area:555.735
Solvation:-3.3985
Coulombic:-34.2822
Bond Count [?]
All:27
Single:18
Double:8
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:350.435
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.89
LogP (Chemaxon):5.45

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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