CAS RN: 2920178-38-5

(7R,8aR)-7-methoxy-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;dihydrochloride

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250709 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
GET A QUOTE

2920178-38-5 / (7R,8aR)-7-methoxy-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;dihydrochloride

(7R,8aR)-7-methoxy-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;dihydrochloride | (7R,8AR)-7-METHOXY-1,2,3,4,6,7,8,8A-OCTAHYDROPYRROLO[1,2-A]PYRAZINE DIHYDROCHLORIDE | MFCD34620755

Standard CAS: 2920178-38-5 Multi CAS: No

Basic Information

CAS
2920178-38-5
Multi CAS
No
Molecular Formula
C8H18CL2N2O
Molecular Weight
229.140000
Exact Mass
228.079619
SMILES
COC1CC2CNCCN2C1.Cl.Cl
InChI
InChI=1S/C8H16N2O.2ClH/c1-11-8-4-7-5-9-2-3-10(7)6-8;;/h7-9H,2-6H2,1H3;2*1H/t7-,8-;;/m1../s1
InChIKey
XNVGKHAOUMZSBN-RHJRFJOKSA-N
Synonyms
(7R,8aR)-7-methoxy-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazine;dihydrochloride (7R,8AR)-7-METHOXY-1,2,3,4,6,7,8,8A-OCTAHYDROPYRROLO[1,2-A]PYRAZINE DIHYDROCHLORIDE MFCD34620755 PS-17737 F86063

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
58.14
TPSA
24.5

LogP / Solubility

WLOGP
0.52
MLOGP
0.46
XLogP3
0.52
Consensus LogP
0.5
Log S (ESOL)
-1.52
Class (ESOL)
Soluble
Log S (Ali)
-1.82
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.7
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)
-3.75

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Get In Touch

Contact Us