CAS RN: 1185310-57-9
N,N-diMethyl-6-(piperazin-1-yl)pyriMidin-4-aMine hydrochloride, 98+% C10H18ClN5, MW: 243.74
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.20250209 | 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1185310-57-9
- Purity/Analytical Methods: >99.0%
1185310-57-9 / N,N-dimethyl-6-piperazin-1-ylpyrimidin-4-amine;hydrochloride
N,N-dimethyl-6-(piperazin-1-yl)pyrimidin-4-amine hydrochloride | N,N-dimethyl-6-piperazin-1-ylpyrimidin-4-amine;hydrochloride | C10H18ClN5
Basic Information
CAS
1185310-57-9
Multi CAS
No
Molecular Formula
C10H18ClN5
Molecular Weight
243.740000
Exact Mass
243.125073
SMILES
CN(C)C1=NC=NC(=C1)N2CCNCC2.Cl
InChI
InChI=1S/C10H17N5.ClH/c1-14(2)9-7-10(13-8-12-9)15-5-3-11-4-6-15;/h7-8,11H,3-6H2,1-2H3;1H
InChIKey
KBKOCXURDKSTTB-UHFFFAOYSA-N
Synonyms
N,N-dimethyl-6-(piperazin-1-yl)pyrimidin-4-amine hydrochloride
N,N-dimethyl-6-piperazin-1-ylpyrimidin-4-amine;hydrochloride
C10H18ClN5
DTXSID30671808
AKOS015941255
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.6
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
68.69
TPSA
44.29
LogP / Solubility
WLOGP
0.37
MLOGP
0.33
XLogP3
0.37
Consensus LogP
0.36
Log S (ESOL)
-1.73
Class (ESOL)
Soluble
Log S (Ali)
-1.83
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.79
Class (SILICOS-IT)
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)
-3.94
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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![CAS 1185310-97-7 3′-Chloro-5′-trifluoroMethyl-3,4,5,6-tetrahydro-2H-[1,2′]bipyridinyl-4-ylaMine hydrochloride, 98+% C11H14Cl2F3N3, MW: 316.15 molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1185310-97-7.gif)
