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CAS 5770-42-3 6-METHYLAMINO-1,3-DIMETHYLURACIL molecular structure lightbox
CAS RN: 5770-42-3

6-METHYLAMINO-1,3-DIMETHYLURACIL

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250512 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS5770-42-3
  • Purity/Analytical Methods: >99.0%
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5770-42-3 / 1,3-dimethyl-6-(methylamino)pyrimidine-2,4-dione

Standard CAS: 5770-42-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5770-42-3
Multi CAS
Yes
Molecular Formula
C7H11N3O2
Molecular Weight
169.180000
Exact Mass
169.085127
InChI
InChI=1S/C7H11N3O2/c1-8-5-4-6(11)10(3)7(12)9(5)2/h4,8H,1-3H3
InChIKey
GODMOSKRIMMTBE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.43
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
46.47
TPSA
56.03

LogP / Solubility

WLOGP
-0.87
MLOGP
-0.77
XLogP3
-0.4
Consensus LogP
-0.68
Log S (ESOL)
-0.64
Class (ESOL)
Very soluble
Log S (Ali)
-0.32
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.15
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-4.37

Drug-likeness / Medicinal Chemistry

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

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