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CAS 1030380-51-8 4,6-Bis(3,5-di(pyridin-4-yl)phenyl)-2-MethylpyriMidine molecular structure lightbox
CAS RN: 1030380-51-8

4,6-Bis(3,5-di(pyridin-4-yl)phenyl)-2-MethylpyriMidine

Product Availability

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260111 100mg In stock Inquiry
Batchno.20260510 500mg Out of stock Inquiry
  • Product code: SSC-004480
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1030380-51-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1030380-51-8 / 4,6-bis(3,5-dipyridin-4-ylphenyl)-2-methylpyrimidine

B4PyMPM | 4,6-bis(3,5-di(pyridin-4-yl)phenyl)-2-methylpyrimidine | 4,6-Bis[3,5-di(4-pyridyl)phenyl]-2-methylpyrimidine

Standard CAS: 1030380-51-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1030380-51-8
Multi CAS
No
Molecular Formula
C37H26N6
Molecular Weight
554.600000
Exact Mass
554.221895
SMILES
CC1=NC(=CC(=N1)C2=CC(=CC(=C2)C3=CC=NC=C3)C4=CC=NC=C4)C5=CC(=CC(=C5)C6=CC=NC=C6)C7=CC=NC=C7
InChI
InChI=1S/C37H26N6/c1-25-42-36(34-20-30(26-2-10-38-11-3-26)18-31(21-34)27-4-12-39-13-5-27)24-37(43-25)35-22-32(28-6-14-40-15-7-28)19-33(23-35)29-8-16-41-17-9-29/h2-24H,1H3
InChIKey
WCXNEXQHQNXXEA-UHFFFAOYSA-N
Synonyms
B4PyMPM 4,6-bis(3,5-di(pyridin-4-yl)phenyl)-2-methylpyrimidine 4,6-Bis[3,5-di(4-pyridyl)phenyl]-2-methylpyrimidine 46-Bis(35-di(pyridin-4-yl)phenyl)-2-methylpyrimidine 4,6-Bis(3,5-di-4-pyridinylphenyl)-2-methylpyrimidine

Computed Properties

Structural Parameters

Heavy atom count
43
Aromatic heavy atom count
42
Fraction Csp3
0.03
Rotatable bonds
6
H-bond acceptors
6
Molar refractivity
170.56
TPSA
77.34

LogP / Solubility

WLOGP
8.37
MLOGP
7.41
XLogP3
6.2
Consensus LogP
7.33
Log S (ESOL)
-8.88
Class (ESOL)
Insoluble
Log S (Ali)
-10.15
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.93
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.16

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6

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