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CAS 1426213-63-9 H-D-Lys(Z)-OtBu·HCl molecular structure lightbox
CAS RN: 1426213-63-9

H-D-Lys(Z)-OtBu·HCl

Product Availability

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2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260310 1g In stock Shandong Inquiry
Batchno.20250603 5g In stock Shanghai, Shandong Inquiry
  • Product code: SSC-053413
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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 1426213-63-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1426213-63-9 / tert-butyl (2R)-2-amino-6-(phenylmethoxycarbonylamino)hexanoate;hydrochloride

Standard CAS: 1426213-63-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1426213-63-9
Multi CAS
No
Molecular Formula
C18H29ClN2O4
Molecular Weight
372.900000
Exact Mass
372.181585
SMILES
CC(C)(C)OC(=O)[C@@H](CCCCNC(=O)OCC1=CC=CC=C1)N.Cl
InChI
InChI=1S/C18H28N2O4.ClH/c1-18(2,3)24-16(21)15(19)11-7-8-12-20-17(22)23-13-14-9-5-4-6-10-14;/h4-6,9-10,15H,7-8,11-13,19H2,1-3H3,(H,20,22);1H/t15-;/m1./s1
InChIKey
HEMZMPXAQORYDR-XFULWGLBSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
8
H-bond acceptors
5
H-bond donors
2
Molar refractivity
99.55
TPSA
90.65

LogP / Solubility

WLOGP
3.17
MLOGP
2.81
XLogP3
3.17
Consensus LogP
3.05
Log S (ESOL)
-3.8
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.91
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.68
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.74

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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