5-((6-Methyl-3-pyridyl)methyl)-2-(nitroamino)-1H-pyrimidin-4-one

HCID 3018360CAS 72716-93-9

기본 정보

표준 SMILES
Cc1ccc(Cc2cnc(N[N+](=O)[O-])[nH]c2=O)cn1
InChIKey
KWBSLRQDOHBJPQ-UHFFFAOYSA-N
분자식
C11H11N5O3
평균 분자량
261.24 g/mol
단동위원소 질량
261.08618923

이름 및 식별자

우선 이름
5-((6-Methyl-3-pyridyl)methyl)-2-(nitroamino)-1H-pyrimidin-4-one
IUPAC
N-[5-[(6-methyl-3-pyridinyl)methyl]-6-oxo-1H-pyrimidin-2-yl]nitramide
영어명
5-[(6-methyl-3-pyridyl)methyl]-2-(nitroamino)-1H-pyrimidin-4-one
분자식
C11H11N5O3
분자량
261.23674

이름 및 동의어

72716-93-9EINECS 276-781-95-((6-Methyl-3-pyridyl)methyl)-2-(nitroamino)-1H-pyrimidin-4-oneSCHEMBL10620753SCHEMBL10655828DTXSID309935322-nitroamino-5-(6-methylpyrid-3-ylmethyl)-4(1H)-pyrimidoneNS000620552-nitroamino-5-(6-methyl-3-pyridyl)methyl-4-pyrimidone2-nitroamino-5-(6-methyl-3-pyridylmethyl)-4-pyrimidone2-nitroamino-5-(6-methylpyrid-3-ylmethyl)-4-pyrimidone2-nitroamino-5-(6-methylpyrid-3-ylmethyl)pyrimid-4-one
이름 더 보기
5-(6-Methylpyridin-3-ylmethyl)-2-(nitroamino)pyrimidin-4(1H)-one5-[(6-methyl-3-pyridyl)methyl]-2-(nitroamino)-1H-pyrimidin-4-one4(3H)-Pyrimidinone,5-[(6-methyl-3-pyridinyl)methyl]-2-(nitroamino)-
2-nitroamino-5-(6-methylpyrid-3ylmethyl)-4-pyrimidone2 -nitroamino-5-(6-methyl-3-pyridylmethyl)-4-pyrimidoneN-{4-Hydroxy-5-[(6-methylpyridin-3-yl)methyl]pyrimidin-2-yl}nitramide

데이터베이스 식별자

CAS
72716-93-9
PubChem CID
3018360
DTXSID
DTXSID30993532
EC Number
276-781-9
Nikkaji
J296.351E

물성

구조 계산 물성

XLogP
1.1
극성 표면적
112 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
5
회전 가능 결합 수
3
무거운 원자 수
19

화학 및 산업

공급사1 곳

湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]

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