CAS RN: 200352-41-6
H-D-CYS(ACM)-OH HCL
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250824 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS200352-41-6
- Purity/Analytical Methods: >99.0%
200352-41-6 / (2S)-3-(acetamidomethylsulfanyl)-2-aminopropanoic acid;hydrochloride
Basic Information
CAS
200352-41-6
Multi CAS
No
Molecular Formula
C6H13ClN2O3S
Molecular Weight
228.700000
Exact Mass
228.033541
SMILES
CC(=O)NCSC[C@H](C(=O)O)N.Cl
InChI
InChI=1S/C6H12N2O3S.ClH/c1-4(9)8-3-12-2-5(7)6(10)11;/h5H,2-3,7H2,1H3,(H,8,9)(H,10,11);1H/t5-;/m1./s1
InChIKey
SZWPOAKLKGUXDD-NUBCRITNSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.67
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
3
Molar refractivity
54
TPSA
92.42
LogP / Solubility
WLOGP
-0.35
MLOGP
-0.31
XLogP3
-0.35
Consensus LogP
-0.34
Log S (ESOL)
-0.71
Class (ESOL)
Very soluble
Log S (Ali)
-1.18
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.45
Class (SILICOS-IT)
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)
-4.37
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
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FMOC-D-CYS(MBZL)-OH
- CAS RN: 200354-41-2
- Product Code: starshine_CAS200354-41-2
- Purity/Analytical method: >99.0%
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