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CAS 13869-38-0 CIS-BIS(ACETONITRILE)DICHLOROPLATINUM(II) molecular structure lightbox
CAS RN: 13869-38-0

CIS-BIS(ACETONITRILE)DICHLOROPLATINUM(II)

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250404 100mg In stock Inquiry
Batchno.20260104 1g In stock Inquiry
Batchno.20251220 250mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250404 100mg In stock Shanghai Inquiry
Batchno.20250209 1g In stock Shanghai Inquiry
Batchno.20260312 250mg In stock Shanghai, Shenzhen Inquiry
  • Product code: starshine_CAS13869-38-0
  • Purity/Analytical Methods: >99.0%
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13869-38-0 / bis(acetonitrile);dichloroplatinum

Standard CAS: 13869-38-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
13869-38-0
Multi CAS
No
Molecular Formula
C4H6Cl2N2Pt
Molecular Weight
348.090000
Exact Mass
346.955598
SMILES
CC#N.CC#N.Cl[Pt]Cl
InChI
InChI=1S/2C2H3N.2ClH.Pt/c2*1-2-3;;;/h2*1H3;2*1H;/q;;;;+2/p-2
InChIKey
NSWGBUVHSQEDRN-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.5
H-bond acceptors
2
Molar refractivity
34.28
TPSA
47.58

LogP / Solubility

WLOGP
2.44
MLOGP
2.16
XLogP3
2.44
Consensus LogP
2.35
Log S (ESOL)
-3.53
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-3.94
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.11

Drug-likeness / Medicinal Chemistry

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

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