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CAS 1229025-32-4 (S)-Methyl 1-aMinopropan-2-ylcarbaMate hydrochloride molecular structure lightbox
CAS RN: 1229025-32-4

(S)-Methyl 1-aMinopropan-2-ylcarbaMate hydrochloride

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250912 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-026605
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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: ＞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 1229025-32-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

1229025-32-4 / methyl N-[(2S)-1-aminopropan-2-yl]carbamate;hydrochloride

Standard CAS: 1229025-32-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1229025-32-4
Multi CAS
No
Molecular Formula
C5H13ClN2O2
Molecular Weight
168.620000
Exact Mass
168.066555
SMILES
C[C@@H](CN)NC(=O)OC.Cl
InChI
InChI=1S/C5H12N2O2.ClH/c1-4(3-6)7-5(8)9-2;/h4H,3,6H2,1-2H3,(H,7,8);1H/t4-;/m0./s1
InChIKey
DTVBZYSSZUCODC-WCCKRBBISA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
41.31
TPSA
64.35

LogP / Solubility

WLOGP
0.11
MLOGP
0.09
XLogP3
0.11
Consensus LogP
0.1
Log S (ESOL)
-0.82
Class (ESOL)
Very soluble
Log S (Ali)
-1.02
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.09
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-3.67

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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