Chemical ID: 6006150

CC(CC(=O)N(C)CC(=O)N1CC(=O)N(C1)c2ccc(cc2)Cl)CC(C)(C)C
Chemical ID:
6006150
Name [?]:
N-[[3-(4-chlorophenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]-N,3,5,5-tetramethyl-hexanamide
SMILES [?]:
CC(CC(=O)N(C)CC(=O)N1CC(=O)N(C1)c2ccc(cc2)Cl)CC(C)(C)C
InChi [?]:
InChI=1/C21H30ClN3O3/c1-15(11-21(2,3)4)10-18(26)23(5)12-19(27)24-13-20(28)25(14-24)17-8-6-16(22)7-9-17/h6-9,15H,10-14H2,1-5H3
InChi Info:
AuxInfo=1/0/N:1,26,27,28,7,19,21,18,22,3,24,8,12,16,2,20,17,4,9,13,25,23,6,11,15,5,10,14/E:(2,3,4)(6,7)(8,9)/rA:28cCCCCONCCCONCCONCCCCCCCClCCCCC/rB:s1;s2;s3;d4;s4;s6;s6;s8;d9;s9;s11;s12;d13;s13;s11s15;s15;s17;d18;s19;d20;d17s21;s20;s2;s24;s25;s25;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H30ClN3O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:11.9315
Area:649.814
Solvation:-4.31385
Coulombic:-49.3902
Bond Count [?]
All:29
Single:23
Double:6
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:407.934
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.18
LogP (Chemaxon):3.1

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Descriptor Annotations

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