Chemical ID: 7387384

Cc1ccccc1C2C3=C(c4ccccc4C3=O)Nc5ccccc5S2
Chemical ID:
7387384
Name [?]:
None
SMILES [?]:
Cc1ccccc1C2C3=C(c4ccccc4C3=O)Nc5ccccc5S2
InChi [?]:
InChI=1/C23H17NOS/c1-14-8-2-3-9-15(14)23-20-21(16-10-4-5-11-17(16)22(20)25)24-18-12-6-7-13-19(18)26-23/h2-13,23-24H,1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,13,14,22,23,3,6,12,15,21,24,2,7,11,16,20,25,9,10,17,8,19,18,26/rA:26cCCCCCCCCCCCCCCCCCONCCCCCCS/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s10;s11;d12;s13;d14;d11s15;s9s16;d17;s10;s19;s20;d21;s22;d23;d20s24;s8s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H17NOS
All Atoms:43
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:10.7995
Area:514.85
Solvation:-2.07172
Coulombic:-24.2167
Bond Count [?]
All:30
Single:19
Double:11
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:355.453
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.75
LogP (Chemaxon):4.78

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Descriptor Annotations

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