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CAS 1467103-13-4 7-Methyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine molecular structure lightbox
CAS RN: 1467103-13-4

7-Methyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260527 100mg Out of stock 1 business days Inquiry
  • Product code: starshine_CAS1467103-13-4
  • Purity/Analytical Methods: >99.0%
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1467103-13-4 / 7-methylpyrrolo[2,3-d]pyrimidin-2-amine

Standard CAS: 1467103-13-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1467103-13-4
Multi CAS
No
Molecular Formula
C7H8N4
Molecular Weight
148.170000
Exact Mass
148.074896
SMILES
CN1C=CC2=CN=C(N=C21)N
InChI
InChI=1S/C7H8N4/c1-11-3-2-5-4-9-7(8)10-6(5)11/h2-4H,1H3,(H2,8,9,10)
InChIKey
PLFJIINDKIPKEN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
4
H-bond donors
1
Molar refractivity
42.92
TPSA
56.73

LogP / Solubility

WLOGP
0.55
MLOGP
0.48
XLogP3
0.3
Consensus LogP
0.44
Log S (ESOL)
-1.71
Class (ESOL)
Soluble
Log S (Ali)
-1.17
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.08
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)
-3.23

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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