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880360-89-4 | 1H-Indole, 2,5-bis(1-pyrrolidinylmethyl)-
CAS No: 880360-89-4 Catalog No: AG004GG2 MDL No:
Product Description
Catalog Number:
AG004GG2
Chemical Name:
1H-Indole, 2,5-bis(1-pyrrolidinylmethyl)-
CAS Number:
880360-89-4
Molecular Formula:
C18H25N3
Molecular Weight:
283.4112
IUPAC Name:
2,5-bis(pyrrolidin-1-ylmethyl)-1H-indole
InChI:
InChI=1S/C18H25N3/c1-2-8-20(7-1)13-15-5-6-18-16(11-15)12-17(19-18)14-21-9-3-4-10-21/h5-6,11-12,19H,1-4,7-10,13-14H2
InChI Key:
FIAVBLMQJURDRW-UHFFFAOYSA-N
SMILES:
C1CCN(C1)Cc1ccc2c(c1)cc([nH]2)CN1CCCC1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.205g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.419g/mol
Monoisotopic Mass:
283.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
22.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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