CAS RN: 109840-91-7

N-Benzyloxycarbonyl Nortropine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250714 1g / 5g / 25g Out of stock 5-7 business days Inquiry
  • Product code: SSC-011152
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g
  • Available purity: >97%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 109840-91-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 5 In Stock Hong Kong Inquiry
1g >97% 5 In Stock Hong Kong Inquiry
5g -- 5 In Stock Hong Kong Inquiry
5g >97% 5 In Stock Beijing Inquiry
10g -- 3 In Stock Hong Kong Inquiry
10g >97% 3 In Stock Beijing Inquiry
25g -- 0 Out of Stock Beijing Inquiry
25g >97% 0 Out of Stock Shenzhen Inquiry

109840-91-7 / benzyl (1S,5R)-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate

N-CBZ-NORTROPINE | N-Benzyloxycarbonyl Nortropine | endo-Benzyl 3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate

Standard CAS: 109840-91-7 Multi CAS: Yes

Basic Information

CAS
109840-91-7
Multi CAS
Yes
Molecular Formula
C15H19NO3
Molecular Weight
261.320000
Exact Mass
261.136493
SMILES
C1C[C@H]2CC(C[C@@H]1N2C(=O)OCC3=CC=CC=C3)O
InChI
InChI=1S/C15H19NO3/c17-14-8-12-6-7-13(9-14)16(12)15(18)19-10-11-4-2-1-3-5-11/h1-5,12-14,17H,6-10H2/t12-,13+,14?
InChIKey
AXRYOOOSGBBQPJ-PBWFPOADSA-N
Synonyms
N-CBZ-NORTROPINE N-Benzyloxycarbonyl Nortropine endo-Benzyl 3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate MFCD09991642 BENZYL (1R,5S)-3-HYDROXY-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
70.52
TPSA
49.77

LogP / Solubility

WLOGP
2.31
MLOGP
2.04
XLogP3
2.1
Consensus LogP
2.15
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.37
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.52
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)
-2.67

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4.5

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