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CAS 174466-48-9 N-(N-Boc-sulfamoyl)glycine Methyl Ester molecular structure lightbox
CAS RN: 174466-48-9

N-(N-Boc-sulfamoyl)glycine Methyl Ester

  • Product code: SSC-076525
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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: 10g, 0.1g, 0.25g, 1g, 5g, 25g
  • Available purity: ≥95%
  • 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 174466-48-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥95% 3 In Stock Beijing Inquiry
0.1g ≥95% 1 In Stock Hong Kong Inquiry
0.25g ≥95% 1 In Stock Beijing Inquiry
1g ≥95% 1 In Stock Hong Kong Inquiry
5g ≥95% 1 In Stock Shenzhen Inquiry
25g ≥95% 1 In Stock Beijing Inquiry

174466-48-9 / methyl 2-[(2-methylpropan-2-yl)oxycarbonylsulfamoylamino]acetate

Standard CAS: 174466-48-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
174466-48-9
Multi CAS
No
Molecular Formula
C8H16N2O6S
Molecular Weight
268.290000
Exact Mass
268.072907
SMILES
CC(C)(C)OC(=O)NS(=O)(=O)NCC(=O)OC
InChI
InChI=1S/C8H16N2O6S/c1-8(2,3)16-7(12)10-17(13,14)9-5-6(11)15-4/h9H,5H2,1-4H3,(H,10,12)
InChIKey
LUFZRUXWJBVEPQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.75
Rotatable bonds
4
H-bond acceptors
6
H-bond donors
2
Molar refractivity
58.31
TPSA
110.8

LogP / Solubility

WLOGP
-0.48
MLOGP
-0.42
XLogP3
0.1
Consensus LogP
-0.27
Log S (ESOL)
-0.94
Class (ESOL)
Very soluble
Log S (Ali)
-1.41
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.48
Class (SILICOS-IT)
Soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.7

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

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