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CAS 1393572-20-7 Pyrido[4,3-d]pyrimidin-5(6H)-one, 2,4-dichloro-7,8-dihydro- molecular structure lightbox
CAS RN: 1393572-20-7

Pyrido[4,3-d]pyrimidin-5(6H)-one, 2,4-dichloro-7,8-dihydro-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251231 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-049899
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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 1393572-20-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1393572-20-7 / 2,4-dichloro-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one

Standard CAS: 1393572-20-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1393572-20-7
Multi CAS
No
Molecular Formula
C7H5Cl2N3O
Molecular Weight
218.040000
Exact Mass
216.980967
SMILES
C1CNC(=O)C2=C1N=C(N=C2Cl)Cl
InChI
InChI=1S/C7H5Cl2N3O/c8-5-4-3(11-7(9)12-5)1-2-10-6(4)13/h1-2H2,(H,10,13)
InChIKey
ZGCMCEDKBAMANU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.29
H-bond acceptors
3
H-bond donors
1
Molar refractivity
48.09
TPSA
54.88

LogP / Solubility

WLOGP
1.07
MLOGP
0.94
XLogP3
1.5
Consensus LogP
1.17
Log S (ESOL)
-2.21
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.12
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.96
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)
-3.29

Drug-likeness / Medicinal Chemistry

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

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