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CAS 107716-98-3 N-Boc-4-oxo-D-proline molecular structure lightbox
CAS RN: 107716-98-3

N-Boc-4-oxo-D-proline

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250313 100mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-009160
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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: 1g
  • Available purity: ≥95%
  • 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 107716-98-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

107716-98-3 / (4S)-1-methyl-2-oxoimidazolidine-4-carboxylic acid

(S)-1-Methyl-2-oxoimidazolidine-4-carboxylic acid | (4S)-1-Methyl-2-oxoimidazolidine-4-carboxylic acid | MFCD27941348

Standard CAS: 107716-98-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
107716-98-3
Multi CAS
Yes
Molecular Formula
C5H8N2O3
Molecular Weight
144.130000
Exact Mass
144.053492
SMILES
CN1C[C@H](NC1=O)C(=O)O
InChI
InChI=1S/C5H8N2O3/c1-7-2-3(4(8)9)6-5(7)10/h3H,2H2,1H3,(H,6,10)(H,8,9)/t3-/m0/s1
InChIKey
AEDVCQIVTIIFMO-VKHMYHEASA-N
Synonyms
(S)-1-Methyl-2-oxoimidazolidine-4-carboxylic acid (4S)-1-Methyl-2-oxoimidazolidine-4-carboxylic acid MFCD27941348 SCHEMBL5365854 AEDVCQIVTIIFMO-VKHMYHEASA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
32.59
TPSA
69.64

LogP / Solubility

WLOGP
-0.91
MLOGP
-0.8
XLogP3
-1
Consensus LogP
-0.9
Log S (ESOL)
-0.1
Class (ESOL)
Very soluble
Log S (Ali)
-0.09
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.03
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.24

Drug-likeness / Medicinal Chemistry

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

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