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CAS 1355195-24-2 4-Chloro-6-isopropyl-5,6,7,8-tetrahydro-pyrido[4,3-d]pyrimidine molecular structure lightbox
CAS RN: 1355195-24-2

4-Chloro-6-isopropyl-5,6,7,8-tetrahydro-pyrido[4,3-d]pyrimidine

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4 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250223 100mg In stock Shanghai Inquiry
Batchno.20250508 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20260530 1g Out of stock Inquiry
Batchno.20260630 250mg In stock Shanghai Inquiry
  • Product code: starshine_CAS1355195-24-2
  • Purity/Analytical Methods: >99.0%
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1355195-24-2 / 4-chloro-6-propan-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine

Standard CAS: 1355195-24-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1355195-24-2
Multi CAS
No
Molecular Formula
C10H14ClN3
Molecular Weight
211.690000
Exact Mass
211.087625
SMILES
CC(C)N1CCC2=C(C1)C(=NC=N2)Cl
InChI
InChI=1S/C10H14ClN3/c1-7(2)14-4-3-9-8(5-14)10(11)13-6-12-9/h6-7H,3-5H2,1-2H3
InChIKey
QOYUTSSEVNMVDC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.6
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
56.29
TPSA
29.02

LogP / Solubility

WLOGP
1.9
MLOGP
1.67
XLogP3
1.9
Consensus LogP
1.82
Log S (ESOL)
-2.6
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.67
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.73
Class (SILICOS-IT)
Moderately 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)
-2.66

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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