Chemical ID: 6003250

CCCC(=O)N(CCN(C)C)CC(=O)Nc1nc(cs1)C
Chemical ID:
6003250
Name [?]:
N-(2-dimethylaminoethyl)-N-[(4-methylthiazol-2-yl)carbamoylmethyl]butanamide
SMILES [?]:
CCCC(=O)N(CCN(C)C)CC(=O)Nc1nc(cs1)C
InChi [?]:
InChI=1/C14H24N4O2S/c1-5-6-13(20)18(8-7-17(3)4)9-12(19)16-14-15-11(2)10-21-14/h10H,5-9H2,1-4H3,(H,15,16,19)
InChi Info:
AuxInfo=1/1/N:1,21,10,11,2,3,8,7,12,19,18,13,4,16,17,15,9,6,14,5,20/E:(3,4)/rA:21nCCCCONCCNCCCCONCNCCSC/rB:s1;s2;s3;d4;s4;s6;s7;s8;s9;s9;s6;s12;d13;s13;s15;d16;s17;d18;s16s19;s18;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H24N4O2S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.19807
Area:543.008
Solvation:-4.37711
Coulombic:-44.9765
Bond Count [?]
All:21
Single:17
Double:4
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:312.432
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:0.39
LogP (Chemaxon):0.71

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