Chemical ID: 5535522

COc1ccc(cc1)N=C2N(C(=O)CC(S2)C(=O)Nc3ccc(cc3)F)Cc4ccc(c(c4)OC)OC
Chemical ID:
5535522
Name [?]:
3-[(3,4-dimethoxyphenyl)methyl]-N-(4-fluorophenyl)-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazinane-6-carboxamide
SMILES [?]:
COc1ccc(cc1)N=C2N(C(=O)CC(S2)C(=O)Nc3ccc(cc3)F)Cc4ccc(c(c4)OC)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H26FN3O5S
All Atoms:37
Heavy Atoms:37
Chiral Atoms:1
ZAP Information [?]
Total:9.23687
Area:735.036
Solvation:-9.13903
Coulombic:-66.2517
Bond Count [?]
All:40
Single:28
Double:12
Rotors:9
Chiral:1
Rigid Segments:8
Chemical Properties
Molecular Weight:523.577
H-Bond Donors:1
H-Bond Acceptors:8
XLogP:3.21
LogP (Chemaxon):5.03

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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