CS-0959687
Tert-butyl 6-(6-chloropyridin-3-yl)-8-oxo-2,5,7-triazaspiro[3.4]oct-6-ene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 2227206-22-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₅H₁₇ClN₄O₃
Molecular Weight
336.77
Synonyms
None
SMILES
O=C1N=C(NC12CN(C(=O)OC(C)(C)C)C2)C=3C=NC(Cl)=CC3
Tpsa
83.89
Logp
1.6009
H Acceptors
5
H Donors
1
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₇ClN₄O₃
Molecular Weight: 336.77
Synonyms: None
SMILES: O=C1N=C(NC12CN(C(=O)OC(C)(C)C)C2)C=3C=NC(Cl)=CC3
Tpsa: 83.89
Logp: 1.6009
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₇ClN₄O₃
Molecular Weight:
336.77
Synonyms:
None
SMILES:
O=C1N=C(NC12CN(C(=O)OC(C)(C)C)C2)C=3C=NC(Cl)=CC3
Tpsa:
83.89
Logp:
1.6009
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₄N₄O₄
Molecular Weight: 278.26
Synonyms: None
SMILES: O=C(O)C1CC(C2=NC=3OCCNC(=O)C3C(=N2)N)C1
Tpsa: 127.43
Logp: -0.2408
H Acceptors: 6
H Donors: 3
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₄N₄O₄
Molecular Weight:
278.26
Synonyms:
None
SMILES:
O=C(O)C1CC(C2=NC=3OCCNC(=O)C3C(=N2)N)C1
Tpsa:
127.43
Logp:
-0.2408
H Acceptors:
6
H Donors:
3
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₁NO₃
Molecular Weight: 263.33
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC2=CC=C(O)C=C2C1(C)C
Tpsa: 49.77
Logp: 3.378
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₁NO₃
Molecular Weight:
263.33
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC2=CC=C(O)C=C2C1(C)C
Tpsa:
49.77
Logp:
3.378
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₅NO₄
Molecular Weight: 271.35
Synonyms: None
SMILES: C(O)(=O)[C@H]1[C@@H](CC(C)C)CN(C(OC(C)(C)C)=O)C1
Tpsa: 66.84
Logp: 2.6002
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₅NO₄
Molecular Weight:
271.35
Synonyms:
None
SMILES:
C(O)(=O)[C@H]1[C@@H](CC(C)C)CN(C(OC(C)(C)C)=O)C1
Tpsa:
66.84
Logp:
2.6002
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3