Chemical ID: 5816910

CC(C)OC(=O)CN1C(=O)C(=Cc2ccc(c(c2)OC)OC(=O)C34CC5CC(C3)CC(C5)C4)SC1=O
Chemical ID:
5816910
Name [?]:
[4-[[3-(isopropoxycarbonylmethyl)-2,4-dioxo-thiazolidin-5-ylidene]methyl]-2-methoxy-phenyl] adamantane-1-carboxylate
SMILES [?]:
CC(C)OC(=O)CN1C(=O)C(=Cc2ccc(c(c2)OC)OC(=O)C34CC5CC(C3)CC(C5)C4)SC1=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H31NO7S
All Atoms:36
Heavy Atoms:36
Chiral Atoms:0
ZAP Information [?]
Total:12.4878
Area:727.031
Solvation:-5.68799
Coulombic:-72.7735
Bond Count [?]
All:40
Single:32
Double:8
Rotors:9
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:513.604
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:4.55
LogP (Chemaxon):4.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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