![CAS 273727-89-2 1-Propanone, 3-[(1-methylethyl)(phenylmethyl)amino]-1-(2-naphthalenyl)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/273727-89-2.gif)
CAS RN: 273727-89-2
1-Propanone, 3-[(1-methylethyl)(phenylmethyl)amino]-1-(2-naphthalenyl)-
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.20260317 | 10mg / 50mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS273727-89-2
- Purity/Analytical Methods: >99.0%
273727-89-2 / 3-[benzyl(propan-2-yl)amino]-1-naphthalen-2-ylpropan-1-one
Basic Information
CAS
273727-89-2
Multi CAS
No
Molecular Formula
C23H25NO
Molecular Weight
331.400000
Exact Mass
331.193614
InChI
InChI=1S/C23H25NO/c1-18(2)24(17-19-8-4-3-5-9-19)15-14-23(25)22-13-12-20-10-6-7-11-21(20)16-22/h3-13,16,18H,14-15,17H2,1-2H3
InChIKey
JSASWRWALCMOQP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
16
Fraction Csp3
0.26
Rotatable bonds
7
H-bond acceptors
2
Molar refractivity
104.88
TPSA
20.31
LogP / Solubility
WLOGP
5.32
MLOGP
4.7
XLogP3
5.1
Consensus LogP
5.04
Log S (ESOL)
-5.26
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.12
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.07
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
No
Log Kp (skin permeation)
-0.96
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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![CAS 273757-03-2 (S)-3-IMidazo[4,5-b]pyridin-3-yl-pyrrolidine-1-carboxylic acid tert-butyl ester molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/273757-03-2.gif)