![CAS 334986-61-7 Benzaldehyde, 4-[[4-(hydroxymethyl)phenyl]phenylamino]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/334986-61-7.gif)
CAS RN: 334986-61-7
Benzaldehyde, 4-[[4-(hydroxymethyl)phenyl]phenylamino]-
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260611 | 100mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20260205 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250918 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250126 | 250mg | In stock | Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250819 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS334986-61-7
- Purity/Analytical Methods: >99.0%
334986-61-7 / 4-(N-[4-(hydroxymethyl)phenyl]anilino)benzaldehyde
Basic Information
CAS
334986-61-7
Multi CAS
No
Molecular Formula
C20H17NO2
Molecular Weight
303.400000
Exact Mass
303.125929
InChI
InChI=1S/C20H17NO2/c22-14-16-6-10-19(11-7-16)21(18-4-2-1-3-5-18)20-12-8-17(15-23)9-13-20/h1-14,23H,15H2
InChIKey
INUBAPZVGSWZDB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
18
Fraction Csp3
0.05
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
92.44
TPSA
40.54
LogP / Solubility
WLOGP
4.46
MLOGP
3.94
XLogP3
3.7
Consensus LogP
4.03
Log S (ESOL)
-4.78
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.27
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.93
Class (SILICOS-IT)
Slightly soluble
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)
-1.4
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
2.5
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