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CAS 296-35-5 1,4,7,10,13,16-HEXAAZACYCLOOCTADECANE molecular structure lightbox
CAS RN: 296-35-5

1,4,7,10,13,16-HEXAAZACYCLOOCTADECANE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250926 100mg In stock Shanghai Inquiry
Batchno.20260528 1g In stock Shanghai Inquiry
Batchno.20250819 250mg In stock Shanghai Inquiry
Batchno.20250102 25mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-132605
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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 296-35-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

296-35-5 / 1,4,7,10,13,16-hexazacyclooctadecane

Standard CAS: 296-35-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
296-35-5
Multi CAS
No
Molecular Formula
C12H30N6
Molecular Weight
258.410000
Exact Mass
258.253195
InChI
InChI=1S/C12H30N6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h13-18H,1-12H2
InChIKey
RVJABZUDCPZPPM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
1
H-bond acceptors
6
H-bond donors
6
Molar refractivity
77.22
TPSA
72.18

LogP / Solubility

WLOGP
-2.46
MLOGP
-2.16
XLogP3
-3.2
Consensus LogP
-2.61
Log S (ESOL)
0.11
Class (ESOL)
Highly soluble
Log S (Ali)
0.1
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.7
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-6.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3

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