CS-1006981
tert-butyl (S)-4-(4-cyanopyrimidin-2-yl)-3-methyl-1,4-diazepane-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2937328-23-7
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₆H₂₃N₅O₂
Molecular Weight
317.39
Synonyms
None
SMILES
C[C@@H]1N(C=2N=C(C#N)C=CN2)CCCN(C(OC(C)(C)C)=O)C1
Tpsa
82.35
Logp
2.18398
H Acceptors
6
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 2937328-23-7 | tert-butyl (3S)-4-(4-cyanopyrimidin-2-yl)-3-methyl-1,4-diazepane-1-carboxylate | A2B Chem | -- |
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₂₃N₅O₂
Molecular Weight: 317.39
Synonyms: None
SMILES: C[C@@H]1N(C=2N=C(C#N)C=CN2)CCCN(C(OC(C)(C)C)=O)C1
Tpsa: 82.35
Logp: 2.18398
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₃N₅O₂
Molecular Weight:
317.39
Synonyms:
None
SMILES:
C[C@@H]1N(C=2N=C(C#N)C=CN2)CCCN(C(OC(C)(C)C)=O)C1
Tpsa:
82.35
Logp:
2.18398
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₄BrN₅O₂S₂
Molecular Weight: 498.46
Synonyms: None
SMILES: S(C)C1=NC(=C2C(=N1)C(C)=C(Br)S2)N3C[C@H](CC#N)N(C(OC(C)(C)C)=O)CC3
Tpsa: 82.35
Logp: 4.8235
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₄BrN₅O₂S₂
Molecular Weight:
498.46
Synonyms:
None
SMILES:
S(C)C1=NC(=C2C(=N1)C(C)=C(Br)S2)N3C[C@H](CC#N)N(C(OC(C)(C)C)=O)CC3
Tpsa:
82.35
Logp:
4.8235
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₈BrNO₂
Molecular Weight: 276.17
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1C[C@H](C)C(Br)=CC1
Tpsa: 29.54
Logp: 3.152
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₈BrNO₂
Molecular Weight:
276.17
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1C[C@H](C)C(Br)=CC1
Tpsa:
29.54
Logp:
3.152
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₃₄BNO₄
Molecular Weight: 351.29
Synonyms: None
SMILES: C(=C\C1CCN(C(OC(C)(C)C)=O)CC1)(\C)/B2OC(C)(C)C(C)(C)O2
Tpsa: 48
Logp: 4.2112
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₃₄BNO₄
Molecular Weight:
351.29
Synonyms:
None
SMILES:
C(=C\C1CCN(C(OC(C)(C)C)=O)CC1)(\C)/B2OC(C)(C)C(C)(C)O2
Tpsa:
48
Logp:
4.2112
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2