Chemical ID: 4912304

Cc1cc(=O)n2c3c4ccccc4ccc3sc2n1
Chemical ID:
4912304
Name [?]:
None
SMILES [?]:
Cc1cc(=O)n2c3c4ccccc4ccc3sc2n1
InChi [?]:
InChI=1/C15H10N2OS/c1-9-8-13(18)17-14-11-5-3-2-4-10(11)6-7-12(14)19-15(17)16-9/h2-8H,1H3
InChi Info:
AuxInfo=1/0/N:1,11,10,12,9,14,15,3,2,13,8,16,4,7,18,19,6,5,17/rA:19nCCCCONCCCCCCCCCCSCN/rB:s1;d2;s3;d4;s4;s6;s7;s8;d9;s10;d11;d8s12;s13;d14;d7s15;s16;s6s17;s2d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10N2OS
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.50091
Area:410.098
Solvation:-1.75154
Coulombic:-23.4254
Bond Count [?]
All:22
Single:14
Double:8
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:266.319
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.74
LogP (Chemaxon):3.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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