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CAS 22735-07-5 diethyl L-cystinate dihydrochloride molecular structure lightbox
CAS RN: 22735-07-5

diethyl L-cystinate dihydrochloride

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251112 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250122 25g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250105 5g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260408 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-110834
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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: ＞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 22735-07-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞95% 0 Out of Stock Hong Kong Inquiry

22735-07-5 / ethyl 2-amino-3-[(2-amino-3-ethoxy-3-oxopropyl)disulfanyl]propanoate;hydrochloride

Standard CAS: 22735-07-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22735-07-5
Multi CAS
No
Molecular Formula
C10H21ClN2O4S2
Molecular Weight
332.900000
Exact Mass
332.063127
SMILES
CCOC(=O)C(CSSCC(C(=O)OCC)N)N.Cl
InChI
InChI=1S/C10H20N2O4S2.2ClH/c1-3-15-9(13)7(11)5-17-18-6-8(12)10(14)16-4-2;;/h7-8H,3-6,11-12H2,1-2H3;2*1H/t7-,8-;;/m0../s1
InChIKey
BDJZWSLXDLQPNZ-FOMWZSOGSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Fraction Csp3
0.8
Rotatable bonds
9
H-bond acceptors
8
H-bond donors
2
Molar refractivity
81.38
TPSA
104.64

LogP / Solubility

WLOGP
0.57
MLOGP
0.52
XLogP3
0.57
Consensus LogP
0.55
Log S (ESOL)
-1.67
Class (ESOL)
Soluble
Log S (Ali)
-2.7
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.38
Class (SILICOS-IT)
Poorly 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)
-4.35

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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