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CAS 1208086-32-1 Methyl 1-(6-Chloro-3-pyridazinyl)piperidine-3-carboxylate molecular structure lightbox
CAS RN: 1208086-32-1

Methyl 1-(6-Chloro-3-pyridazinyl)piperidine-3-carboxylate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260219 2g Out of stock 5-7 business days Inquiry
  • Product code: SSC-022156
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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, 5g
  • 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 1208086-32-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

1208086-32-1 / methyl 1-(6-chloropyridazin-3-yl)piperidine-3-carboxylate

Methyl 1-(6-Chloro-3-pyridazinyl)piperidine-3-carboxylate | methyl 1-(6-chloropyridazin-3-yl)piperidine-3-carboxylate | MFCD07368264

Standard CAS: 1208086-32-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1208086-32-1
Multi CAS
No
Molecular Formula
C11H14ClN3O2
Molecular Weight
255.700000
Exact Mass
255.077454
SMILES
COC(=O)C1CCCN(C1)C2=NN=C(C=C2)Cl
InChI
InChI=1S/C11H14ClN3O2/c1-17-11(16)8-3-2-6-15(7-8)10-5-4-9(12)13-14-10/h4-5,8H,2-3,6-7H2,1H3
InChIKey
SIJUGBZUEMOBKB-UHFFFAOYSA-N
Synonyms
Methyl 1-(6-Chloro-3-pyridazinyl)piperidine-3-carboxylate methyl 1-(6-chloropyridazin-3-yl)piperidine-3-carboxylate MFCD07368264 1-(6-Chloro-pyridazin-3-yl)-piperidine-3-carboxylic acid methyl ester Methyl1-(6-Chloro-3-pyridazinyl)piperidine-3-carboxylate

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.55
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
64
TPSA
55.32

LogP / Solubility

WLOGP
1.52
MLOGP
1.34
XLogP3
1.6
Consensus LogP
1.49
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.75
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.82
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.2

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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