Chemical ID: 4091948

CC(C)(C)N(C(=O)c1cccc(c1)C(=O)N(C(C)(C)C)NC(=O)c2ccccc2)NC(=O)c3ccccc3
Chemical ID:
4091948
Name [?]:
N1',N3'-dibenzoyl-N1,N3-ditert-butyl-benzene-1,3-dicarbohydrazide
SMILES [?]:
CC(C)(C)N(C(=O)c1cccc(c1)C(=O)N(C(C)(C)C)NC(=O)c2ccccc2)NC(=O)c3ccccc3
InChi [?]:
InChI=1/C30H34N4O4/c1-29(2,3)33(31-25(35)21-14-9-7-10-15-21)27(37)23-18-13-19-24(20-23)28(38)34(30(4,5)6)32-26(36)22-16-11-8-12-17-22/h7-20H,1-6H3,(H,31,35)(H,32,36)
InChi Info:
AuxInfo=1/1/N:1,3,4,18,19,20,36,27,35,37,26,28,10,34,38,25,29,9,11,13,33,24,8,12,31,22,6,14,2,17,30,21,5,16,32,23,7,15/E:(1,2,3,4,5,6)(7,8)(9,10,11,12)(14,15,16,17)(18,19)(21,22)(23,24)(25,26)(27,28)(29,30)(31,32)(33,34)(35,36)(37,38)/gE:(1,2)/rA:38nCCCCNCOCCCCCCCONCCCCNCOCCCCCCNCOCCCCCC/rB:s1;s2;s2;s2;s5;d6;s6;s8;d9;s10;d11;d8s12;s12;d14;s14;s16;s17;s17;s17;s16;s21;d22;s22;s24;d25;s26;d27;d24s28;s5;s30;d31;s31;s33;d34;s35;d36;d33s37;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C30H34N4O4
All Atoms:38
Heavy Atoms:38
Chiral Atoms:0
ZAP Information [?]
Total:13.7795
Area:738.929
Solvation:-4.69375
Coulombic:-69.5016
Bond Count [?]
All:40
Single:27
Double:13
Rotors:12
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:514.616
H-Bond Donors:2
H-Bond Acceptors:8
XLogP:6.41
LogP (Chemaxon):4.21

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