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CAS 1256633-21-2 N-Cbz-2-(hydroxyMethyl)hoMoMorpholine molecular structure lightbox
CAS RN: 1256633-21-2

N-Cbz-2-(hydroxyMethyl)hoMoMorpholine

  • Product code: SSC-030573
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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: 0.25g, 0.1g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 1
  • 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 1256633-21-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >95% 1 In Stock Beijing Inquiry
0.1g >95% 0 Out of Stock Hong Kong Inquiry
1g >95% 0 Out of Stock Hong Kong Inquiry
5g >95% 0 Out of Stock Beijing Inquiry

1256633-21-2 / benzyl 2-(hydroxymethyl)-1,4-oxazepane-4-carboxylate

Standard CAS: 1256633-21-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1256633-21-2
Multi CAS
No
Molecular Formula
C14H19NO4
Molecular Weight
265.300000
Exact Mass
265.131408
SMILES
C1CN(CC(OC1)CO)C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C14H19NO4/c16-10-13-9-15(7-4-8-18-13)14(17)19-11-12-5-2-1-3-6-12/h1-3,5-6,13,16H,4,7-11H2
InChIKey
GBFMGKGLICBMMI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
1
Molar refractivity
69.64
TPSA
59

LogP / Solubility

WLOGP
1.41
MLOGP
1.25
XLogP3
1
Consensus LogP
1.22
Log S (ESOL)
-2.41
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.75
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.91
Class (SILICOS-IT)
Moderately 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)
-3.34

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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