CAS RN: 2070015-13-1
ML241 (hydrochloride)
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250604 | 5mg / 25mg / 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS2070015-13-1
- Purity/Analytical Methods: >99.0%
2070015-13-1 / N-benzyl-2-(2,3-dihydro-1,4-benzoxazin-4-yl)-5,6,7,8-tetrahydroquinazolin-4-amine;hydrochloride
Basic Information
CAS
2070015-13-1
Multi CAS
No
Molecular Formula
C23H25ClN4O
Molecular Weight
408.900000
Exact Mass
408.171689
SMILES
C1CCC2=C(C1)C(=NC(=N2)N3CCOC4=CC=CC=C43)NCC5=CC=CC=C5.Cl
InChI
InChI=1S/C23H24N4O.ClH/c1-2-8-17(9-3-1)16-24-22-18-10-4-5-11-19(18)25-23(26-22)27-14-15-28-21-13-7-6-12-20(21)27;/h1-3,6-9,12-13H,4-5,10-11,14-16H2,(H,24,25,26);1H
InChIKey
DYHMHNNBOLCULH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
18
Fraction Csp3
0.3
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
1
Molar refractivity
118.63
TPSA
50.28
LogP / Solubility
WLOGP
4.92
MLOGP
4.35
XLogP3
4.92
Consensus LogP
4.73
Log S (ESOL)
-5.67
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.47
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.88
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.72
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
UNC2025 HCI
- CAS RN: 2070015-17-5
- Product Code: starshine_CAS2070015-17-5
- Purity/Analytical method: >99.0%
-
ILK-IN-2
- CAS RN: 2070015-22-2
- Product Code: starshine_CAS2070015-22-2
- Purity/Analytical method: >99.0%
-
N1,N2-Dimethyl-N1-[[3-[4-[[trans-3-[2-(tetrahydro-2H-pyran-4-yl)ethoxy]cyclobutyl]oxy]phenyl]-1H-pyrazol-4-yl]methyl]-1,2-ethanediamine hydrochloride
- CAS RN: 2070015-25-5
- Product Code: starshine_CAS2070015-25-5
- Purity/Analytical method: >99.0%
-
SRT3025 Hydrochloride
- CAS RN: 2070015-26-6
- Product Code: starshine_CAS2070015-26-6
- Purity/Analytical method: >99.0%
-
SJB3-019A
- CAS RN: 2070015-29-9
- Product Code: starshine_CAS2070015-29-9
- Purity/Analytical method: >99.0%
-
IDO-IN-3
- CAS RN: 2070018-30-1
- Product Code: starshine_CAS2070018-30-1
- Purity/Analytical method: >99.0%
![CAS 2070015-25-5 N1,N2-Dimethyl-N1-[[3-[4-[[trans-3-[2-(tetrahydro-2H-pyran-4-yl)ethoxy]cyclobutyl]oxy]phenyl]-1H-pyrazol-4-yl]methyl]-1,2-ethanediamine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2070015-25-5.png)
