(3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-ol

Name: (3R,4S,5R,6R)-3,4,5-tris(benzyloxy)-6-((benzyloxy)methyl)tetrahydro-2H-pyran-2-ol
SKU: PI4132289
Rating: 5 (1 reviews)

Cat. No.: PI4132289

Product Details Other Identifiers Computed Properties

CAS	4132-28-9
Purity	98%
Molecular Formula	C34H36O6
Linear Formula	C6H12O6(C7H6)4
Molecular Weight	540.65
Molar Refractivity	152.6

Pubchem ID	10940502
InChI Key	OGOMAWHSXRDAKZ-BKJHVTENSA-N
MDL Number	MFCD00066004

Hydrogen Bond Donor Count	1.0
Hydrogen Bond Acceptor Count	6.0
Rotatable Bond Count	13
Topological Polar Surface Area	66.38 Å²
Heavy Atom Count	40
Aromatic Heavy Atoms Number	24
Fraction Csp3	0.29
Log Po/w (iLOGP)	4.61
Log Po/w (XLOGP3)	4.98
Log Po/w (WLOGP)	5.07
Log Po/w (MLOGP)	2.86
Log Po/w (SILICOS-IT)	5.62
Consensus Log Po/w	4.63
GI Absorption	High
BBB Permeant	Yes
P-gp Substrate	Yes
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	Yes
Log Kp (Skin Permeation)	-6.06 cm/s
Lipinski	1.0
Ghose	None
Veber	1.0
Egan	0.0
Muegge	0.0
Bioavailability Score	0.55
PAINS	0.0 alert
Brenk	0.0 alert
Leadlikeness	3.0
Synthetic Accessibility	5.59

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