![CAS 135673-97-1 N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-3-cyclohexyl-L-alanine molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/f0857-jpgcontextbwfzdgvyfhjvb3r8mze5mdl8aw1hz2uvanblz3xozjkvadawlzg5mza3mdu1mzkxmdivrja4ntcuanbnfdq5zduwogq0nti5ngnmmwqznzi0y2y2mjljn2vmmdi3mdqwzge2nwyymjk5ndkxzwflztdkzja1m2q4ntu0mdc.jpeg)
CAS RN: 135673-97-1
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-3-cyclohexyl-L-alanine
Product Availability
Choose a grade to view its available package options.
7 package records5 with current stock2 grade groups
- Product code: SSC-044222
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 10g, 5g, 1g, 25g, 100g, 500g
- Available purity: >98%
- Inventory rows with stock: 6
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 10g | >98% | 5 In Stock | Shanghai | Inquiry |
| 5g | >98% | 3 In Stock | Beijing | Inquiry |
| 1g | >98% | 2 In Stock | Hong Kong | Inquiry |
| 25g | >98% | 2 In Stock | Hong Kong | Inquiry |
| 100g | >98% | 1 In Stock | Shenzhen | Inquiry |
| 500g | >98% | 1 In Stock | Hong Kong | Inquiry |
135673-97-1 / (2S)-3-cyclohexyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
Basic Information
CAS
135673-97-1
Multi CAS
No
Molecular Formula
C24H27NO4
Molecular Weight
393.500000
Exact Mass
393.194008
SMILES
C1CCC(CC1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C24H27NO4/c26-23(27)22(14-16-8-2-1-3-9-16)25-24(28)29-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h4-7,10-13,16,21-22H,1-3,8-9,14-15H2,(H,25,28)(H,26,27)/t22-/m0/s1
InChIKey
HIJAUEZBPWTKIV-QFIPXVFZSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
12
Fraction Csp3
0.42
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
2
Molar refractivity
110.82
TPSA
75.63
LogP / Solubility
WLOGP
4.95
MLOGP
4.38
XLogP3
5.8
Consensus LogP
5.04
Log S (ESOL)
-5.31
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.36
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.05
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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