Chemical ID: 5115164

c1ccc2c(c1)c3c(s2)C(=O)NCC3
Chemical ID:
5115164
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)c3c(s2)C(=O)NCC3
InChi [?]:
InChI=1/C11H9NOS/c13-11-10-8(5-6-12-11)7-3-1-2-4-9(7)14-10/h1-4H,5-6H2,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,14,13,5,7,4,8,10,12,11,9/rA:14nCCCCCCCCSCONCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s8;d10;s10;s12;s7s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H9NOS
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.99684
Area:349.818
Solvation:-1.7486
Coulombic:-23.2683
Bond Count [?]
All:16
Single:11
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:203.261
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.55
LogP (Chemaxon):1.72

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Descriptor Annotations

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