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CAS 710977-70-1 TERT-BUTYL4-(OXAN-4-YLAMINO)PIPERIDINE-1-CARBOXYLATE(WXC08109) molecular structure lightbox
CAS RN: 710977-70-1

TERT-BUTYL4-(OXAN-4-YLAMINO)PIPERIDINE-1-CARBOXYLATE(WXC08109)

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251125 100mg / 250mg / 1g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS710977-70-1
  • Purity/Analytical Methods: >99.0%
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710977-70-1 / tert-butyl 4-(oxan-4-ylamino)piperidine-1-carboxylate

Standard CAS: 710977-70-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
710977-70-1
Multi CAS
Yes
Molecular Formula
C15H28N2O3
Molecular Weight
284.390000
Exact Mass
284.209993
InChI
InChI=1S/C15H28N2O3/c1-15(2,3)20-14(18)17-8-4-12(5-9-17)16-13-6-10-19-11-7-13/h12-13,16H,4-11H2,1-3H3
InChIKey
OBEVPDNEUFHSBB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Fraction Csp3
0.93
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
77.81
TPSA
50.8

LogP / Solubility

WLOGP
2.15
MLOGP
1.91
XLogP3
1.6
Consensus LogP
1.89
Log S (ESOL)
-2.83
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.45
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.54
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.93

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

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