CAS RN: 336182-29-7
4-Bromo-N-isopropylbenzamide
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.20260414 | 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS336182-29-7
- Purity/Analytical Methods: >99.0%
336182-29-7 / N-benzyl-2-bromo-N-methylacetamide
Basic Information
CAS
336182-29-7
Multi CAS
Yes
Molecular Formula
BC10H12ORn
Molecular Weight
242.110000
Exact Mass
241.010230
InChI
InChI=1S/C10H12BrNO/c1-7(2)12-10(13)8-3-5-9(11)6-4-8/h3-7H,1-2H3,(H,12,13)
InChIKey
PWXNCWKINUCUPV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
56.71
TPSA
20.31
LogP / Solubility
WLOGP
2.04
MLOGP
1.8
XLogP3
2
Consensus LogP
1.95
Log S (ESOL)
-2.77
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.02
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.29
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)
-2.75
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
-
tert-butyl 3,3-dimethyl-4-methylidenepiperidine-1-carboxylate
- CAS RN: 336182-49-1
- Product Code: SSC-139771
-
R-2,2′-dihydroxy-α,α,α’,α’-tetraphenyl-[1,1′-Binaphthalene]-3,3′-diMethanol
- CAS RN: 336185-31-0
- Product Code: starshine_CAS336185-31-0
- Purity/Analytical method: >99.0%
-
8-BENZYL-2,8-DIAZA-SPIRO[4.5]DECANE
- CAS RN: 336191-15-2
- Product Code: starshine_CAS336191-15-2
- Purity/Analytical method: >99.0%
-
tert-Butyl 8-benzyl-2,8-diazaspiro[4.5]decane-2-carboxylate
- CAS RN: 336191-16-3
- Product Code: starshine_CAS336191-16-3
- Purity/Analytical method: >99.0%
-
2,8-DIAZA-SPIRO[4.5]DECANE-2-CARBOXYLIC ACID TERT-BUTYL ESTER
- CAS RN: 336191-17-4
- Product Code: SSC-139772
-
2,3-DIHYDRO-7-(2,3-DIHYDROTHIENO[3,4-B][1,4]DIOXIN-5-YL)THIENO[3,4-B][1,4]DIOXINE-5-CARBALDEHYDE
- CAS RN: 336607-95-5
- Product Code: starshine_CAS336607-95-5
- Purity/Analytical method: >99.0%
![CAS 336185-31-0 R-2,2′-dihydroxy-α,α,α’,α’-tetraphenyl-[1,1′-Binaphthalene]-3,3′-diMethanol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/336185-31-0.gif)
![CAS 336191-15-2 8-BENZYL-2,8-DIAZA-SPIRO[4.5]DECANE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/336191-15-2.gif)
![CAS 336191-16-3 tert-Butyl 8-benzyl-2,8-diazaspiro[4.5]decane-2-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/336191-16-3.gif)
![CAS 336191-17-4 2,8-DIAZA-SPIRO[4.5]DECANE-2-CARBOXYLIC ACID TERT-BUTYL ESTER molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/336191-17-4.gif)
![CAS 336607-95-5 2,3-DIHYDRO-7-(2,3-DIHYDROTHIENO[3,4-B][1,4]DIOXIN-5-YL)THIENO[3,4-B][1,4]DIOXINE-5-CARBALDEHYDE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/336607-95-5.gif)