CAS RN: 71822-97-4
3-amino-6-bromo-2-methylquinazolin-4(3H)-one
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.20260119 | 500mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS71822-97-4
- Purity/Analytical Methods: >99.0%
71822-97-4 / 3-amino-6-bromo-2-methylquinazolin-4-one
Basic Information
CAS
71822-97-4
Multi CAS
No
Molecular Formula
BC9H8ORn3
Molecular Weight
254.080000
Exact Mass
252.985070
InChI
InChI=1S/C9H8BrN3O/c1-5-12-8-3-2-6(10)4-7(8)9(14)13(5)11/h2-4H,11H2,1H3
InChIKey
WVFFEYPEJIRJEQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.11
H-bond acceptors
4
H-bond donors
1
Molar refractivity
58.59
TPSA
60.91
LogP / Solubility
WLOGP
1.18
MLOGP
1.05
XLogP3
0.8
Consensus LogP
1.01
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.5
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.29
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.43
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
2-methyl-2-(4-nitrophenyl)propanenitrile
- CAS RN: 71825-51-9
- Product Code: starshine_CAS71825-51-9
- Purity/Analytical method: >99.0%
-
Avermectin A1a, 5-O-demethyl-22,23-dihydro-
- CAS RN: 71827-03-7
- Product Code: starshine_CAS71827-03-7
- Purity/Analytical method: >99.0%
-
-
-
SATIVAN
- CAS RN: 71831-00-0
- Product Code: starshine_CAS71831-00-0
- Purity/Analytical method: >99.0%
-
