Home Other Building Blocks rac-5-[(3aR,6aR)-octahydrocyclopenta[c]pyrrol-3a-yl]-3-benzyl-1,2,4-oxadiazole hydrochloride, cis

rac-5-[(3aR,6aR)-octahydrocyclopenta[c]pyrrol-3a-yl]-3-benzyl-1,2,4-oxadiazole hydrochloride, cis

CAS No.:
1807937-76-3
Catalog Number:
AG01BTYA
Molecular Formula:
C16H20ClN3O
Molecular Weight:
305.8025
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Product Description
Catalog Number:
AG01BTYA
Chemical Name:
rac-5-[(3aR,6aR)-octahydrocyclopenta[c]pyrrol-3a-yl]-3-benzyl-1,2,4-oxadiazole hydrochloride, cis
CAS Number:
1807937-76-3
Molecular Formula:
C16H20ClN3O
Molecular Weight:
305.8025
MDL Number:
MFCD28145308
IUPAC Name:
5-[(3aR,6aR)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-3a-yl]-3-benzyl-1,2,4-oxadiazole;hydrochloride
InChI:
InChI=1S/C16H19N3O.ClH/c1-2-5-12(6-3-1)9-14-18-15(20-19-14)16-8-4-7-13(16)10-17-11-16;/h1-3,5-6,13,17H,4,7-11H2;1H/t13-,16-;/m0./s1
InChI Key:
NMNZBAOZCYWBRN-LINSIKMZSA-N
SMILES:
c1ccc(cc1)Cc1noc(n1)[C@@]12CCC[C@H]2CNC1.Cl
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
305.129g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
305.806g/mol
Monoisotopic Mass:
305.129g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties