CAS RN: 7012-94-4
7-Chloro-2-phenyl-1H-quinazolin-4-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.20260223 | 500mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS7012-94-4
- Purity/Analytical Methods: >99.0%
7012-94-4 / 7-chloro-2-phenyl-3H-quinazolin-4-one
Basic Information
CAS
7012-94-4
Multi CAS
Yes
Molecular Formula
C14H9CLN2O
Molecular Weight
256.680000
Exact Mass
256.040341
InChI
InChI=1S/C14H9ClN2O/c15-10-6-7-11-12(8-10)16-13(17-14(11)18)9-4-2-1-3-5-9/h1-8H,(H,16,17,18)
InChIKey
DWSBXSUAJILPPH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
16
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
72.81
TPSA
45.75
LogP / Solubility
WLOGP
3.24
MLOGP
2.86
XLogP3
3
Consensus LogP
3.03
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.14
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.98
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
-
-
-
-
-
6-methylthiopurine ribonucleoside-5′-phosphate
- CAS RN: 7021-52-5
- Product Code: starshine_CAS7021-52-5
- Purity/Analytical method: >99.0%
-
2H-Benzimidazol-2-one,1,3-dihydro-1-methyl-,hydrazone(9CI)
- CAS RN: 7022-37-9
- Product Code: starshine_CAS7022-37-9
- Purity/Analytical method: >99.0%
