![CAS 146426-00-8 1H-Pyrrole-2,5-dione, 1-[3-(methylphenylamino)propyl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/146426-00-8.gif)
CAS RN: 146426-00-8
1H-Pyrrole-2,5-dione, 1-[3-(methylphenylamino)propyl]-
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.20251104 | 100mg | In stock | Shanghai, Shenzhen, Tianjin | Inquiry | |
| Batchno.20260611 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20260403 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250819 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry | |
| Batchno.20250421 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS146426-00-8
- Purity/Analytical Methods: >99.0%
146426-00-8 / 1-[3-(N-methylanilino)propyl]pyrrole-2,5-dione
Basic Information
CAS
146426-00-8
Multi CAS
No
Molecular Formula
C14H16N2O2
Molecular Weight
244.290000
Exact Mass
244.121178
SMILES
CN(CCCN1C(=O)C=CC1=O)C2=CC=CC=C2
InChI
InChI=1S/C14H16N2O2/c1-15(12-6-3-2-4-7-12)10-5-11-16-13(17)8-9-14(16)18/h2-4,6-9H,5,10-11H2,1H3
InChIKey
DBJCHYFZMPMUGF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
70.19
TPSA
40.62
LogP / Solubility
WLOGP
1.44
MLOGP
1.27
XLogP3
1.7
Consensus LogP
1.47
Log S (ESOL)
-2.18
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.6
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.04
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.19
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
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]
Precautionary Statement Codes
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Customers Also Viewed
-
-
Velutinam
- CAS RN: 146428-62-8
- Product Code: starshine_CAS146428-62-8
- Purity/Analytical method: >99.0%
-
2-Pyridinecarboximidic acid, 2-[(2,5-dimethoxyphenyl)methylene]hydrazide
- CAS RN: 146430-05-9
- Product Code: starshine_CAS146430-05-9
- Purity/Analytical method: >99.0%
-
N,N-BIS(T-BUTYL-4-CARBOXYMETHYL)AMINOETHANOL
- CAS RN: 146432-41-9
- Product Code: SSC-057473
-
-
H-SER-ILE-LYS-VAL-ALA-VAL-OH
- CAS RN: 146439-94-3
- Product Code: starshine_CAS146439-94-3
- Purity/Analytical method: >99.0%
![CAS 146430-05-9 2-Pyridinecarboximidic acid, 2-[(2,5-dimethoxyphenyl)methylene]hydrazide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/146430-05-9.gif)
