Chemical ID: 6152645

CN1C(=O)CC(SC1=Nc2ccc(cc2)C(=O)OC)C(=O)Nc3cccc(c3)OC
Chemical ID:
6152645
Name [?]:
methyl 4-[[6-[(3-methoxyphenyl)carbamoyl]-3-methyl-4-oxo-1,3-thiazinan-2-ylidene]amino]benzoate
SMILES [?]:
CN1C(=O)CC(SC1=Nc2ccc(cc2)C(=O)OC)C(=O)Nc3cccc(c3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H21N3O5S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:10.2099
Area:643.745
Solvation:-5.88374
Coulombic:-67.5596
Bond Count [?]
All:32
Single:22
Double:10
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:427.475
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:1.71
LogP (Chemaxon):3.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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