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CAS 49705-98-8 Benzyl (2R,3S)-(1-carbamoyl-2-hydroxypropyl)carbamate molecular structure lightbox
CAS RN: 49705-98-8

Benzyl (2R,3S)-(1-carbamoyl-2-hydroxypropyl)carbamate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250901 5g / 10g / 25g / 100g Out of stock 8-10 business days Inquiry
  • Product code: SSC-155975
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 25g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 49705-98-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Hong Kong Inquiry

49705-98-8 / benzyl N-(1-amino-3-hydroxy-1-oxobutan-2-yl)carbamate

Standard CAS: 49705-98-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
49705-98-8
Multi CAS
Yes
Molecular Formula
C12H16N2O4
Molecular Weight
252.270000
Exact Mass
252.111007
InChI
InChI=1S/C12H16N2O4/c1-8(15)12(10(13)16,18-11(14)17)7-9-5-3-2-4-6-9/h2-6,8,15H,7H2,1H3,(H2,13,16)(H2,14,17)/t8-,12+/m0/s1
InChIKey
XYJIXTMTYOGXGG-QPUJVOFHSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
3
Molar refractivity
64.43
TPSA
101.65

LogP / Solubility

WLOGP
0.15
MLOGP
0.14
XLogP3
0.3
Consensus LogP
0.2
Log S (ESOL)
-1.41
Class (ESOL)
Soluble
Log S (Ali)
-1.74
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
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)
-4.15

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5

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