(2R,3R,4R,5S)-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidine

(2R,3R,4R,5S)-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidine

CAS: 69567-11-9

Formula: C34H37NO4

SMILES: C(OCC1=CC=CC=C1)[C@H]1NC[C@H](OCC2=CC=CC=C2)[C@@H](OCC2=CC=CC=C2)[C@@H]1OCC1=CC=CC=C1

IUPAC: (2R,3R,4R,5S)-3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]piperidine

InChI: InChI=1S/C34H37NO4/c1-5-13-27(14-6-1)22-36-26-31-33(38-24-29-17-9-3-10-18-29)34(39-25-30-19-11-4-12-20-30)32(21-35-31)37-23-28-15-7-2-8-16-28/h1-20,31-35H,21-26H2/t31-,32+,33-,34-/m1/s1

Composition: C (77.98%), H (7.12%), N (2.67%), O (12.22%)

Molar Mass: 523.673

Atom Count: 76

Heavy Atom Count: 39

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	4
Exact Mass	523.272258675
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	HHIIDKLQTCPFQA-KMKAFXEASA-N
Lipinski's Rule of Five
Molar Refractivity	154.03
Topological Polar Surface Area	48.95
Polarizability	61.12
Ring Count	5
Rotatable Bond Count	13

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