Chemical ID: 6773472

CCCCNC(=O)CSc1nc2c(c(n[nH]2)C)c(=N)n1c3ccc(cc3)C
Chemical ID:
6773472
Name [?]:
N-butyl-2-[[5-imino-7-methyl-4-(p-tolyl)-2,4,8,9-tetrazabicyclo[4.3.0]nona-2,7,10-trien-3-yl]sulfanyl]acetamide
SMILES [?]:
CCCCNC(=O)CSc1nc2c(c(n[nH]2)C)c(=N)n1c3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H24N6OS
All Atoms:51
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.714
Area:618.032
Solvation:-3.73675
Coulombic:-54.8441
Bond Count [?]
All:29
Single:21
Double:8
Rotors:8
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:384.5
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.06
LogP (Chemaxon):3.23

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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