Chemical ID: 6449573

C1CCC(CC1)NC(=NC2CCCCC2)NC34CC5CC(C3)C(C5)C4
Chemical ID:
6449573
Name [?]:
None
SMILES [?]:
C1CCC(CC1)NC(=NC2CCCCC2)NC34CC5CC(C3)C(C5)C4
InChi [?]:
InChI=1/C22H37N3/c1-3-7-19(8-4-1)23-21(24-20-9-5-2-6-10-20)25-22-13-16-11-17(14-22)18(12-16)15-22/h16-20H,1-15H2,(H2,23,24,25)
InChi Info:
AuxInfo=1/1/N:1,13,2,6,12,14,3,5,11,15,20,24,18,22,25,19,21,23,4,10,8,17,7,9,16/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(14,15)(17,18)(19,20)(23,24)/rA:25cCCCCCCNCNCCCCCCNCCCCCCCCC/rB:s1;s2;s3;s4;s1s5;s4;s7;w8;s9;s10;s11;s12;s13;s10s14;s8;s16;s17;s18;s19;s20;s17s21;s21;s19s23;s17s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H37N3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:2
ZAP Information [?]
Total:12.5665
Area:551.593
Solvation:-1.22337
Coulombic:-31.6975
Bond Count [?]
All:29
Single:28
Double:1
Rotors:5
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:343.549
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:6.11
LogP (Chemaxon):4.77

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Descriptor Annotations

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