CAS RN: 87460-09-1
Benzyl hydroxy(4-phenylbutyl)phosphinoylacetate
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250621 | 10g | Out of stock | Inquiry | ||
| Batchno.20250805 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250614 | 250mg | In stock | Shenzhen, Tianjin, Chengdu | Inquiry | |
| Batchno.20250407 | 250mg / 1g / 5g | Confirm by inquiry | Shanghai | 8-10 business days | Inquiry |
| Batchno.20250625 | 5g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: starshine_CAS87460-09-1
- Purity/Analytical Methods: >99.0%
87460-09-1 / (2-oxo-2-phenylmethoxyethyl)-(4-phenylbutyl)phosphinic acid
Basic Information
CAS
87460-09-1
Multi CAS
Yes
Molecular Formula
C19H23O4P
Molecular Weight
346.400000
Exact Mass
346.133396
InChI
InChI=1S/C19H23O4P/c20-19(23-15-18-12-5-2-6-13-18)16-24(21,22)14-8-7-11-17-9-3-1-4-10-17/h1-6,9-10,12-13H,7-8,11,14-16H2,(H,21,22)
InChIKey
GVDMCYBWLREELG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.32
Rotatable bonds
9
H-bond acceptors
3
H-bond donors
1
Molar refractivity
95.18
TPSA
63.6
LogP / Solubility
WLOGP
4.02
MLOGP
3.56
XLogP3
3
Consensus LogP
3.53
Log S (ESOL)
-4.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.33
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.98
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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