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CAS 55650-59-4 (S)-N,N-Dimethyl-1-[(R)-1′,2-bis(diphenylphosphino)ferrocenyl]ethylamine molecular structure lightbox
CAS RN: 55650-59-4

(S)-N,N-Dimethyl-1-[(R)-1′,2-bis(diphenylphosphino)ferrocenyl]ethylamine

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250413 100mg In stock Shanghai Inquiry
Batchno.20250906 1g In stock Shanghai Inquiry
Batchno.20251023 250mg In stock Shanghai Inquiry
Batchno.20250725 25mg / 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-163573
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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 55650-59-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

55650-59-4 / cyclopenta-1,3-dien-1-yl(diphenyl)phosphane;1-(2-diphenylphosphanylcyclopenta-1,4-dien-1-yl)-N,N-dimethylethanamine;iron(2+)

Standard CAS: 55650-59-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
55650-59-4
Multi CAS
Yes
Molecular Formula
C38H37FENP2
Molecular Weight
625.500000
Exact Mass
625.175060
InChI
InChI=1S/C21H23NP.C17H14P.Fe/c1-17(22(2)3)20-15-10-16-21(20)23(18-11-6-4-7-12-18)19-13-8-5-9-14-19;1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;/h4-17H,1-3H3;1-14H;/q2*-1;+2
InChIKey
IEEIDZAXDTVGGN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
42
Aromatic heavy atom count
34
Fraction Csp3
0.11
Rotatable bonds
8
H-bond acceptors
1
Molar refractivity
183.58
TPSA
3.24

LogP / Solubility

WLOGP
6.95
MLOGP
6.16
XLogP3
6.95
Consensus LogP
6.69
Log S (ESOL)
-8.17
Class (ESOL)
Insoluble
Log S (Ali)
-9.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.45
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)
-1.6

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
6

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