![CAS 1354752-71-8 L-Norleucine, 6-(1,1-dimethylethoxy)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1354752-71-8.gif)
CAS RN: 1354752-71-8
L-Norleucine, 6-(1,1-dimethylethoxy)-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250802 | 250mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1354752-71-8
- Purity/Analytical Methods: >99.0%
1354752-71-8 / (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[(2-methylpropan-2-yl)oxy]hexanoic acid
Basic Information
CAS
1354752-71-8
Multi CAS
No
Molecular Formula
C25H31NO5
Molecular Weight
425.500000
Exact Mass
425.220223
SMILES
CC(C)(C)OCCCC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C25H31NO5/c1-25(2,3)31-15-9-8-14-22(23(27)28)26-24(29)30-16-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,21-22H,8-9,14-16H2,1-3H3,(H,26,29)(H,27,28)/t22-/m0/s1
InChIKey
JHVAEFIVCBTPPD-QFIPXVFZSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
12
Fraction Csp3
0.44
Rotatable bonds
9
H-bond acceptors
4
H-bond donors
2
Molar refractivity
119.18
TPSA
84.86
LogP / Solubility
WLOGP
4.96
MLOGP
4.4
XLogP3
4.6
Consensus LogP
4.65
Log S (ESOL)
-5.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.63
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.63
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.79
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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![CAS 1354752-76-3 (2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(prop-2-yn-1-ylsulfanyl)propanoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1354752-76-3.gif)
