Chemical ID: 5992601

CCC(C)C(C(=O)Nc1nnc(s1)c2ccc(cc2)N(C)C)NC(=O)Nc3ccccc3OCC
Chemical ID:
5992601
Name [?]:
N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethoxyphenyl)carbamoylamino]-3-methyl-pentanamide
SMILES [?]:
CCC(C)C(C(=O)Nc1nnc(s1)c2ccc(cc2)N(C)C)NC(=O)Nc3ccccc3OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H32N6O3S
All Atoms:35
Heavy Atoms:35
Chiral Atoms:2
ZAP Information [?]
Total:14.3076
Area:770.893
Solvation:-4.96476
Coulombic:-75.5851
Bond Count [?]
All:37
Single:27
Double:10
Rotors:13
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:496.626
H-Bond Donors:3
H-Bond Acceptors:7
XLogP:5.14
LogP (Chemaxon):4.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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