Chemical ID: 5152997

c1ccc2c(c1)Nc3c(cccc3S2)C(=O)N
Chemical ID:
5152997
Name [?]:
10H-phenothiazine-1-carboxamide
SMILES [?]:
c1ccc2c(c1)Nc3c(cccc3S2)C(=O)N
InChi [?]:
InChI=1/C13H10N2OS/c14-13(16)8-4-3-7-11-12(8)15-9-5-1-2-6-10(9)17-11/h1-7,15H,(H2,14,16)
InChi Info:
AuxInfo=1/1/N:1,2,11,10,6,3,12,9,5,4,13,8,15,17,7,16,14/rA:17nCCCCCCNCCCCCCSCON/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;d9;s10;d11;d8s12;s4s13;s9;d15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10N2OS
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.85809
Area:390.781
Solvation:-1.91145
Coulombic:-39.4053
Bond Count [?]
All:19
Single:12
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:242.297
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:2.67
LogP (Chemaxon):3.06

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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