Chemical ID: 5240740

c1ccc(cc1)c2c3n(c(c2c4ccc(cc4)Cl)CO)CCC3
Chemical ID:
5240740
Name [?]:
[2-(4-chlorophenyl)-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]methanol
SMILES [?]:
c1ccc(cc1)c2c3n(c(c2c4ccc(cc4)Cl)CO)CCC3
InChi [?]:
InChI=1/C20H18ClNO/c21-16-10-8-15(9-11-16)20-18(13-23)22-12-4-7-17(22)19(20)14-5-2-1-3-6-14/h1-3,5-6,8-11,23H,4,7,12-13H2
InChi Info:
AuxInfo=1/0/N:1,2,6,22,3,5,23,13,17,14,16,21,19,4,12,15,8,10,7,11,18,9,20/E:(2,3)(5,6)(8,9)(10,11)/rA:23nCCCCCCCCNCCCCCCCCClCOCCC/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;s9;s7d10;s11;s12;d13;s14;d15;d12s16;s15;s10;s19;s9;s21;s8s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H18ClNO
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.3413
Area:519.416
Solvation:-2.64407
Coulombic:-25.7513
Bond Count [?]
All:26
Single:18
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:323.816
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.87
LogP (Chemaxon):4.41

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Descriptor Annotations

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