![CAS 1007096-37-8 (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-6-(phenylformamido)hexanoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1007096-37-8.gif)
CAS RN: 1007096-37-8
(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-6-(phenylformamido)hexanoic acid
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.20250330 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-001389
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: >95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >95% | 0 Out of Stock | Shenzhen | Inquiry |
1007096-37-8 / (2S)-6-benzamido-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid
Fmoc-Lys(Bz)-OH | N2-(((9H-fluoren-9-yl)methoxy)carbonyl)-N6-benzoyl-L-lysine | Fmoc-Lys(Bzo)-OH
Basic Information
CAS
1007096-37-8
Multi CAS
Yes
Molecular Formula
C28H28N2O5
Molecular Weight
472.500000
Exact Mass
472.199822
SMILES
C1=CC=C(C=C1)C(=O)NCCCC[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C28H28N2O5/c31-26(19-10-2-1-3-11-19)29-17-9-8-16-25(27(32)33)30-28(34)35-18-24-22-14-6-4-12-20(22)21-13-5-7-15-23(21)24/h1-7,10-15,24-25H,8-9,16-18H2,(H,29,31)(H,30,34)(H,32,33)/t25-/m0/s1
InChIKey
FCHKYEOLYRBPJT-VWLOTQADSA-N
Synonyms
Fmoc-Lys(Bz)-OH
N2-(((9H-fluoren-9-yl)methoxy)carbonyl)-N6-benzoyl-L-lysine
Fmoc-Lys(Bzo)-OH
MFCD08275870
(2S)-6-benzamido-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
18
Fraction Csp3
0.25
Rotatable bonds
10
H-bond acceptors
4
H-bond donors
3
Molar refractivity
132.25
TPSA
104.73
LogP / Solubility
WLOGP
4.58
MLOGP
4.06
XLogP3
4.7
Consensus LogP
4.45
Log S (ESOL)
-5.37
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.74
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.73
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.35
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
3.5
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