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CAS 1609964-38-6 tert-Butyl 1-imino-1-oxo-1(lambda6)-thiomorpholine-4-carboxylate molecular structure lightbox
CAS RN: 1609964-38-6

tert-Butyl 1-imino-1-oxo-1(lambda6)-thiomorpholine-4-carboxylate

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251006 100mg In stock Shanghai Inquiry
Batchno.20250515 100mg / 250mg / 1g Out of stock 15 business days Inquiry
Batchno.20260206 1g In stock Shanghai Inquiry
Batchno.20250411 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250930 50mg In stock Shanghai Inquiry
Batchno.20250902 5g In stock Shanghai Inquiry
  • Product code: SSC-068755
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1609964-38-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Shenzhen Inquiry
0.25g >95% 1 In Stock Shanghai Inquiry
1g >95% 1 In Stock Hong Kong Inquiry
5g >95% 0 Out of Stock Beijing Inquiry

1609964-38-6 / tert-butyl 1-imino-1-oxo-1,4-thiazinane-4-carboxylate

Standard CAS: 1609964-38-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1609964-38-6
Multi CAS
No
Molecular Formula
C9H18N2O3S
Molecular Weight
234.320000
Exact Mass
234.103814
SMILES
CC(C)(C)OC(=O)N1CCS(=N)(=O)CC1
InChI
InChI=1S/C9H18N2O3S/c1-9(2,3)14-8(12)11-4-6-15(10,13)7-5-11/h10H,4-7H2,1-3H3
InChIKey
YCOLCFXJGBOPGF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.89
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
58.4
TPSA
70.46

LogP / Solubility

WLOGP
1.28
MLOGP
1.13
XLogP3
1.5
Consensus LogP
1.3
Log S (ESOL)
-2.1
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.41
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.25
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.24

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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