Chemical ID: 5920871

Cc1ccsc1CN(Cc2ccc3c(c2)OCO3)C(=O)CN(CC=C)C(=O)C
Chemical ID:
5920871
Name [?]:
N-allyl-N-[[benzo[1,3]dioxol-5-ylmethyl-[(3-methyl-2-thienyl)methyl]carbamoyl]methyl]acetamide
SMILES [?]:
Cc1ccsc1CN(Cc2ccc3c(c2)OCO3)C(=O)CN(CC=C)C(=O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H24N2O4S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.37794
Area:599.15
Solvation:-5.60081
Coulombic:-49.2798
Bond Count [?]
All:30
Single:22
Double:8
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:400.492
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:2.16
LogP (Chemaxon):2.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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