Chemical ID: 4615013

CCOC(=O)c1c(csc1NC(=O)c2ccc(cc2)C(C)(C)C)c3ccc(cc3)C
Chemical ID:
4615013
Name [?]:
ethyl 4-(p-tolyl)-2-(4-tert-butylbenzoyl)amino-thiophene-3-carboxylate
SMILES [?]:
CCOC(=O)c1c(csc1NC(=O)c2ccc(cc2)C(C)(C)C)c3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27NO3S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:13.7519
Area:666.096
Solvation:-2.90049
Coulombic:-44.3146
Bond Count [?]
All:32
Single:22
Double:10
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:421.553
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:7.24
LogP (Chemaxon):7.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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