Chemical ID: 6007341

CCCCCN(CC(=O)Nc1nccs1)C(=O)c2ccc(cc2OC)OC
Chemical ID:
6007341
Name [?]:
2,4-dimethoxy-N-pentyl-N-(thiazol-2-ylcarbamoylmethyl)benzamide
SMILES [?]:
CCCCCN(CC(=O)Nc1nccs1)C(=O)c2ccc(cc2OC)OC
InChi [?]:
InChI=1/C19H25N3O4S/c1-4-5-6-10-22(13-17(23)21-19-20-9-11-27-19)18(24)15-8-7-14(25-2)12-16(15)26-3/h7-9,11-12H,4-6,10,13H2,1-3H3,(H,20,21,23)
InChi Info:
AuxInfo=1/1/N:1,27,25,2,3,4,20,19,13,5,14,22,7,21,18,23,8,16,11,12,10,6,9,17,26,24,15/rA:27nCCCCCNCCONCNCCSCOCCCCCCOCOC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s8;s10;d11;s12;d13;s11s14;s6;d16;s16;s18;d19;s20;d21;d18s22;s23;s24;s21;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H25N3O4S
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:7.79661
Area:629.384
Solvation:-7.938
Coulombic:-54.6883
Bond Count [?]
All:28
Single:21
Double:7
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:391.486
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:2.63
LogP (Chemaxon):2.63

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Descriptor Annotations

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