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CAS 912361-56-9 2-(Adamantan-1-yl)-1H-pyrrole molecular structure lightbox
CAS RN: 912361-56-9

2-(Adamantan-1-yl)-1H-pyrrole

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250826 100mg In stock Shanghai Inquiry
Batchno.20260412 1g In stock Shanghai Inquiry
Batchno.20250109 250mg In stock Shanghai Inquiry
Batchno.20260607 25mg / 100mg Out of stock 8-10 business days Inquiry
Batchno.20260212 5g In stock Shanghai Inquiry
  • Product code: SSC-204123
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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: ＞97%
  • 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 912361-56-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

912361-56-9 / 2-(1-adamantyl)-1H-pyrrole

Standard CAS: 912361-56-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
912361-56-9
Multi CAS
No
Molecular Formula
C14H19N
Molecular Weight
201.310000
Exact Mass
201.151750
InChI
InChI=1S/C14H19N/c1-2-13(15-3-1)14-7-10-4-11(8-14)6-12(5-10)9-14/h1-3,10-12,15H,4-9H2
InChIKey
UFEYSLWXIVXTAH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
5
Fraction Csp3
0.71
Rotatable bonds
1
H-bond donors
1
Molar refractivity
60.64
TPSA
15.79

LogP / Solubility

WLOGP
3.48
MLOGP
3.06
XLogP3
3.6
Consensus LogP
3.38
Log S (ESOL)
-3.46
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.73
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.98
Class (SILICOS-IT)
Poorly 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)
-1.48

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
6.5

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