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CAS 500997-69-3 (11AR)-(+)-10,11,12,13-TETRAHYDRODIINDENO[7,1-DE:1′,7′-FG][1,3,2]DIOXAPHOSPHOCIN-5-BIS(R)-1PHENYLETHYL]AMINE molecular structure lightbox
CAS RN: 500997-69-3

(11AR)-(+)-10,11,12,13-TETRAHYDRODIINDENO[7,1-DE:1′,7′-FG][1,3,2]DIOXAPHOSPHOCIN-5-BIS(R)-1PHENYLETHYL]AMINE

Product Availability

Choose a grade to view its available package options.

7 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260304 25mg / 100mg / 250mg Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260612 100mg Out of stock Inquiry
Batchno.20251117 10g Out of stock Inquiry
Batchno.20251016 1g In stock Shenzhen, Chengdu Inquiry
Batchno.20251231 250mg In stock Shenzhen, Chengdu Inquiry
Batchno.20250628 50mg Out of stock Inquiry
Batchno.20250327 5g Out of stock Inquiry
  • Product code: SSC-156473
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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: ＞98%
  • 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 500997-69-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞98% 0 Out of Stock Beijing Inquiry

500997-69-3 / N,N-bis[(1R)-1-phenylethyl]-4,5,6,7-tetrahydroiindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin-12-amine

Standard CAS: 500997-69-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
500997-69-3
Multi CAS
Yes
Molecular Formula
C33H32NO2P
Molecular Weight
505.600000
Exact Mass
505.217066
InChI
InChI=1S/C33H32NO2P/c1-23(25-11-5-3-6-12-25)34(24(2)26-13-7-4-8-14-26)37-35-29-17-9-15-27-19-21-33(31(27)29)22-20-28-16-10-18-30(36-37)32(28)33/h3-18,23-24H,19-22H2,1-2H3/t23-,24-,33?/m1/s1
InChIKey
ZXLQLIDJAURBDD-HRPAVAKOSA-N

Computed Properties

Structural Parameters

Heavy atom count
37
Aromatic heavy atom count
24
Fraction Csp3
0.27
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
150.03
TPSA
21.7

LogP / Solubility

WLOGP
8.69
MLOGP
7.68
XLogP3
8.6
Consensus LogP
8.32
Log S (ESOL)
-8.6
Class (ESOL)
Insoluble
Log S (Ali)
-9.98
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.76
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.36

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
8

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