CAS RN: 146476-38-2
(S)-1-(diphenylphosphino)-3-phenylpropan-2-aMine
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.20260307 | 50mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS146476-38-2
- Purity/Analytical Methods: >99.0%
146476-38-2 / (2S)-1-diphenylphosphanyl-3-phenylpropan-2-amine
Basic Information
CAS
146476-38-2
Multi CAS
No
Molecular Formula
C21H22NP
Molecular Weight
319.400000
Exact Mass
319.148987
SMILES
C1=CC=C(C=C1)C[C@@H](CP(C2=CC=CC=C2)C3=CC=CC=C3)N
InChI
InChI=1S/C21H22NP/c22-19(16-18-10-4-1-5-11-18)17-23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,19H,16-17,22H2/t19-/m0/s1
InChIKey
SIOSCJGIYDRXMO-IBGZPJMESA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
18
Fraction Csp3
0.14
Rotatable bonds
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
102.06
TPSA
26.02
LogP / Solubility
WLOGP
3.69
MLOGP
3.26
XLogP3
4.1
Consensus LogP
3.68
Log S (ESOL)
-4.33
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.84
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.52
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.05
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
Customers Also Viewed
-
Complanatoside A
- CAS RN: 146501-37-3
- Product Code: starshine_CAS146501-37-3
- Purity/Analytical method: >99.0%
-
Carbamic acid, (3-hydroxy-1-methylpropyl)-, 1,1-dimethylethyl ester (9CI)
- CAS RN: 146514-31-0
- Product Code: SSC-057523
-
-
-
-
