CAS RN: 850033-67-9
2-N-Cbz-2-methylpropane-1,2-diamine-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.20250322 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS850033-67-9
- Purity/Analytical Methods: >99.0%
850033-67-9 / benzyl N-(1-amino-2-methylpropan-2-yl)carbamate;hydrochloride
Basic Information
CAS
850033-67-9
Multi CAS
No
Molecular Formula
C12H19CLN2O2
Molecular Weight
258.740000
Exact Mass
258.113506
InChI
InChI=1S/C12H18N2O2.ClH/c1-12(2,9-13)14-11(15)16-8-10-6-4-3-5-7-10;/h3-7H,8-9,13H2,1-2H3,(H,14,15);1H
InChIKey
QCZRRUYZVDJUJR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.42
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
70.14
TPSA
64.35
LogP / Solubility
WLOGP
2.07
MLOGP
1.83
XLogP3
2.07
Consensus LogP
1.99
Log S (ESOL)
-2.75
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.18
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.54
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
S-2-N-CBZ-propane-1,2-diamine-HCl
- CAS RN: 850033-71-5
- Product Code: starshine_CAS850033-71-5
- Purity/Analytical method: >99.0%
-
R-2-N-CBZ-propane-1,2-diaMine-HCl
- CAS RN: 850033-74-8
- Product Code: starshine_CAS850033-74-8
- Purity/Analytical method: >99.0%
-
-
ETHYL 5-(4-FORMYLPHENYL)-2-THIOPHENECARBOXYLATE
- CAS RN: 850074-81-6
- Product Code: SSC-192862
-
(2,5-Dioxopyrrolidin-1-yl) 11-azidoundecanoate
- CAS RN: 850080-13-6
- Product Code: SSC-192864
-
2-Chloro-5-methylpyridine-4-carboxylic acid ethyl ester
- CAS RN: 850080-86-3
- Product Code: SSC-192865
