Chemical ID: 6687084

CCCN1C(C1c2ccccc2)c3ccccc3
Chemical ID:
6687084
Name [?]:
2,3-diphenyl-1-propyl-aziridine
SMILES [?]:
CCCN1C(C1c2ccccc2)c3ccccc3
InChi [?]:
InChI=1/C17H19N/c1-2-13-18-16(14-9-5-3-6-10-14)17(18)15-11-7-4-8-12-15/h3-12,16-17H,2,13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,10,16,9,11,15,17,8,12,14,18,3,7,13,6,5,4/E:(3,4)(5,6,7,8)(9,10,11,12)(14,15)(16,17)/rA:18cCCCNCCCCCCCCCCCCCC/rB:s1;s2;s3;s4;s4s5;s6;s7;d8;s9;d10;d7s11;s5;s13;d14;s15;d16;d13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19N
All Atoms:18
Heavy Atoms:18
Chiral Atoms:2
ZAP Information [?]
Total:9.88147
Area:448.833
Solvation:-1.33934
Coulombic:-9.75413
Bond Count [?]
All:20
Single:14
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:237.339
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.26
LogP (Chemaxon):4.48

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Descriptor Annotations

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