CAS RN: 82252-39-9
BOC-LEU-(R)-VAL-OH
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.20260206 | 5g / 25g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS82252-39-9
- Purity/Analytical Methods: >99.0%
82252-39-9 / (2S)-3-methyl-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentyl]azaniumyl]butanoate
Basic Information
CAS
82252-39-9
Multi CAS
Yes
Molecular Formula
C16H32N2O4
Molecular Weight
316.440000
Exact Mass
316.236208
InChI
InChI=1S/C16H32N2O4/c1-10(2)8-12(18-15(21)22-16(5,6)7)9-17-13(11(3)4)14(19)20/h10-13,17H,8-9H2,1-7H3,(H,18,21)(H,19,20)/t12-,13-/m0/s1
InChIKey
GNQZRCXIDDSAME-STQMWFEESA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Fraction Csp3
0.88
Rotatable bonds
8
H-bond acceptors
4
H-bond donors
2
Molar refractivity
83.04
TPSA
95.07
LogP / Solubility
WLOGP
0.26
MLOGP
0.25
XLogP3
1.6
Consensus LogP
0.7
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-2.35
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.9
Class (SILICOS-IT)
Moderately 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)
-4.46
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
-
-
Etomoxir
- CAS RN: 82258-36-4
- Product Code: starshine_CAS82258-36-4
- Purity/Analytical method: >99.0%
-
Benzene, 1-(3-chloropropyl)-3-(trifluoroMethyl)-
- CAS RN: 82258-76-2
- Product Code: starshine_CAS82258-76-2
- Purity/Analytical method: >99.0%
-
-
