CAS RN: 35691-16-8
(2-Chloroquinazolin-4-yl)-dimethylamine
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.20250215 | 500mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS35691-16-8
- Purity/Analytical Methods: >99.0%
35691-16-8 / 2-chloro-N,N-dimethylquinazolin-4-amine
Basic Information
CAS
35691-16-8
Multi CAS
No
Molecular Formula
C10H10CLN3
Molecular Weight
207.660000
Exact Mass
207.056325
InChI
InChI=1S/C10H10ClN3/c1-14(2)9-7-5-3-4-6-8(7)12-10(11)13-9/h3-6H,1-2H3
InChIKey
DTTPDWSQHPZGEY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
58.88
TPSA
29.02
LogP / Solubility
WLOGP
2.35
MLOGP
2.07
XLogP3
3.1
Consensus LogP
2.51
Log S (ESOL)
-3.07
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.96
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.08
Class (SILICOS-IT)
Poorly 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)
-2.32
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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