CAS RN: 1522718-34-8
1-methyl-3-(3-nitrophenyl)-2-Imidazolidinone
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.20260505 | 50mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1522718-34-8
- Purity/Analytical Methods: >99.0%
1522718-34-8 / 1-methyl-3-(3-nitrophenyl)imidazolidin-2-one
Basic Information
CAS
1522718-34-8
Multi CAS
No
Molecular Formula
C10H11N3O3
Molecular Weight
221.210000
Exact Mass
221.080041
SMILES
CN1CCN(C1=O)C2=CC(=CC=C2)[N+](=O)[O-]
InChI
InChI=1S/C10H11N3O3/c1-11-5-6-12(10(11)14)8-3-2-4-9(7-8)13(15)16/h2-4,7H,5-6H2,1H3
InChIKey
REPMDCBXXHJOGA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
58.47
TPSA
66.69
LogP / Solubility
WLOGP
1.47
MLOGP
1.29
XLogP3
0.9
Consensus LogP
1.22
Log S (ESOL)
-2.28
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.56
Class (SILICOS-IT)
Moderately 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)
-3.03
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
Customers Also Viewed
-
-
![CAS 1523068-91-8 6-METHOXYSPIRO[CYCLOPROPANE-1,3-INDOLINE] molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1523068-91-8.gif)
6-METHOXYSPIRO[CYCLOPROPANE-1,3-INDOLINE]
- CAS RN: 1523068-91-8
- Product Code: starshine_CAS1523068-91-8
- Purity/Analytical method: >99.0%
-
(2S)-2-AMINO-4,4-DIMETHYLPENTAN-1-OL HYDROCHLORIDE
- CAS RN: 1523246-79-8
- Product Code: starshine_CAS1523246-79-8
- Purity/Analytical method: >99.0%
-
.gif)
4-(4-bromophenyl)-4-(methoxymethoxy)cyclohexanone(WXC03565)
- CAS RN: 1523365-96-9
- Product Code: SSC-062085
-
![CAS 1523406-39-4 (S)-1-((5-chloropyridin-3-yl)methyl)-8-((R)-3-methylmorpholino)-2-(trifluoromethyl)-3,4-dihydro-1H-pyrimido[1,2-a]pyrimidin-6(2H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1523406-39-4(2).gif)
(S)-1-((5-chloropyridin-3-yl)methyl)-8-((R)-3-methylmorpholino)-2-(trifluoromethyl)-3,4-dihydro-1H-pyrimido[1,2-a]pyrimidin-6(2H)-one
- CAS RN: 1523406-39-4
- Product Code: starshine_CAS1523406-39-4
- Purity/Analytical method: >99.0%
-
![CAS 1523412-59-0 (S)-8-((R)-3-methylmorpholino)-2-(trifluoromethyl)-3,4-dihydro-1H-pyrimido[1,2-a]pyrimidin-6(2H)-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1523412-59-0.gif)
(S)-8-((R)-3-methylmorpholino)-2-(trifluoromethyl)-3,4-dihydro-1H-pyrimido[1,2-a]pyrimidin-6(2H)-one
- CAS RN: 1523412-59-0
- Product Code: SSC-062088