Chemical ID: 6875363

CCCCn1cnc2c(c1=O)c(c(s2)C)c3ccc(cc3)C
Chemical ID:
6875363
Name [?]:
4-butyl-8-methyl-7-(p-tolyl)-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-5-one
SMILES [?]:
CCCCn1cnc2c(c1=O)c(c(s2)C)c3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H20N2OS
All Atoms:42
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:11.0002
Area:513.432
Solvation:-1.83563
Coulombic:-24.1062
Bond Count [?]
All:24
Single:17
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:312.43
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.68
LogP (Chemaxon):4.32

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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