[email protected]
CAS 676994-65-3 Pyrido[4,3-d]pyrimidine, 5,6,7,8-tetrahydro-2-methyl- (9CI) molecular structure lightbox
CAS RN: 676994-65-3

Pyrido[4,3-d]pyrimidine, 5,6,7,8-tetrahydro-2-methyl- (9CI)

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251014 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS676994-65-3
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

676994-65-3 / 2-methyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

Standard CAS: 676994-65-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
676994-65-3
Multi CAS
No
Molecular Formula
C8H11N3
Molecular Weight
149.190000
Exact Mass
149.095297
InChI
InChI=1S/C8H11N3/c1-6-10-5-7-4-9-3-2-8(7)11-6/h5,9H,2-4H2,1H3
InChIKey
WFGUTPUYXDVQLK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.5
H-bond acceptors
3
H-bond donors
1
Molar refractivity
42.18
TPSA
37.81

LogP / Solubility

WLOGP
0.43
MLOGP
0.37
Consensus LogP
0.27
Log S (ESOL)
-1.44
Class (ESOL)
Soluble
Log S (Ali)
-1.09
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.99
Class (SILICOS-IT)
Very 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)
-3.32

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us